Record Information |
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Version | 5.0 |
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Status | Expected but not Quantified |
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Creation Date | 2005-11-16 15:48:42 UTC |
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Update Date | 2022-03-07 02:49:07 UTC |
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HMDB ID | HMDB0000920 |
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Secondary Accession Numbers | |
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Metabolite Identification |
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Common Name | 11a-Hydroxyprogesterone |
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Description | Progesterone is a C-21 steroid hormone involved in the female menstrual cycle, pregnancy (supports gestation) and embryogenesis of humans and other species. Progesterone belongs to a class of hormones called progestagens, and is the major naturally occurring human progestagen. Progesterone's reproductive function serves to convert the endometrium to its secretory stage to prepare the uterus for implantation. If pregnancy does not occur, progesterone levels will decrease leading to menstruation in the human. Normal menstrual bleeding is a progesterone withdrawal bleeding. During implantation and gestation, progesterone appears to decrease the maternal immune response to allow for the acceptance of the pregnancy. Progesterone decreases contractility of the uterine musculature. The fetus metabolizes placental progesterone in the production of adrenal mineralo- and glucosteroids. A drop in progesterone levels is possibly one step that facilitates the onset of labor. In addition, progesterone inhibits lactation during pregnancy. The fall in progesterone levels following delivery is one of the triggers for milk production. Progesterone has an effect upon vaginal epithelium and cervical mucus. |
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Structure | [H][C@@]12CCC(C(C)=O)[C@@]1(C)C[C@@H](O)[C@@]1([H])[C@@]2([H])CCC2=CC(=O)CC[C@]12C InChI=1S/C21H30O3/c1-12(22)16-6-7-17-15-5-4-13-10-14(23)8-9-20(13,2)19(15)18(24)11-21(16,17)3/h10,15-19,24H,4-9,11H2,1-3H3/t15-,16?,17-,18+,19+,20-,21+/m0/s1 |
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Synonyms | Value | Source |
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11-Hydroxyprogesterone | HMDB | 11a-Hydroxy-pregn-4-ene-3,20-dione | HMDB | 11a-Hydroxy-progesterone | HMDB | 11a-Hydroxypregn-4-ene-3,20-dione | HMDB | 4-Pregnene-11a-ol-3,20-dione | HMDB | Pregn-4-en-11a-ol-3,20-dione | HMDB | 11Α-hydroxyprogesterone | HMDB | 11a-Hydroxyprogesterone | Generator |
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Chemical Formula | C21H30O3 |
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Average Molecular Weight | 330.4611 |
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Monoisotopic Molecular Weight | 330.219494826 |
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IUPAC Name | (1S,2R,10S,11S,15S,17R)-14-acetyl-17-hydroxy-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-6-en-5-one |
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Traditional Name | (1S,2R,10S,11S,15S,17R)-14-acetyl-17-hydroxy-2,15-dimethyltetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-6-en-5-one |
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CAS Registry Number | 312-90-3 |
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SMILES | [H][C@@]12CCC(C(C)=O)[C@@]1(C)C[C@@H](O)[C@@]1([H])[C@@]2([H])CCC2=CC(=O)CC[C@]12C |
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InChI Identifier | InChI=1S/C21H30O3/c1-12(22)16-6-7-17-15-5-4-13-10-14(23)8-9-20(13,2)19(15)18(24)11-21(16,17)3/h10,15-19,24H,4-9,11H2,1-3H3/t15-,16?,17-,18+,19+,20-,21+/m0/s1 |
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InChI Key | BFZHCUBIASXHPK-ODYOLWGQSA-N |
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Chemical Taxonomy |
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Description | Belongs to the class of organic compounds known as gluco/mineralocorticoids, progestogins and derivatives. These are steroids with a structure based on a hydroxylated prostane moiety. |
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Kingdom | Organic compounds |
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Super Class | Lipids and lipid-like molecules |
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Class | Steroids and steroid derivatives |
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Sub Class | Pregnane steroids |
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Direct Parent | Gluco/mineralocorticoids, progestogins and derivatives |
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Alternative Parents | |
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Substituents | - Progestogin-skeleton
- 20-oxosteroid
- 3-oxo-delta-4-steroid
- 3-oxosteroid
- 11-hydroxysteroid
- 11-alpha-hydroxysteroid
- Hydroxysteroid
- Oxosteroid
- Delta-4-steroid
- Cyclohexenone
- Cyclic alcohol
- Ketone
- Secondary alcohol
- Cyclic ketone
- Hydrocarbon derivative
- Organic oxygen compound
- Carbonyl group
- Alcohol
- Organic oxide
- Organooxygen compound
- Aliphatic homopolycyclic compound
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Molecular Framework | Aliphatic homopolycyclic compounds |
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External Descriptors | Not Available |
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Ontology |
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Physiological effect | Not Available |
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Disposition | |
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Process | |
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Role | |
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Physical Properties |
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State | Solid |
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Experimental Molecular Properties | Property | Value | Reference |
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Melting Point | 222 °C | Not Available | Boiling Point | Not Available | Not Available | Water Solubility | 0.05 mg/mL | Not Available | LogP | 2.36 | HANSCH,C ET AL. (1995) |
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Experimental Chromatographic Properties | Not Available |
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Predicted Molecular Properties | | Show more...
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Predicted Chromatographic Properties | Predicted Collision Cross SectionsPredicted Kovats Retention IndicesUnderivatizedDerivatizedDerivative Name / Structure | SMILES | Kovats RI Value | Column Type | Reference |
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11a-Hydroxyprogesterone,1TMS,isomer #1 | CC(=O)C1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@H](O[Si](C)(C)C)C[C@]12C | 3054.3 | Semi standard non polar | 33892256 | 11a-Hydroxyprogesterone,1TMS,isomer #2 | CC(O[Si](C)(C)C)=C1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@H](O)C[C@]12C | 3074.9 | Semi standard non polar | 33892256 | 11a-Hydroxyprogesterone,1TMS,isomer #3 | CC(=O)C1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C)=CC[C@]4(C)[C@H]3[C@H](O)C[C@]12C | 2955.2 | Semi standard non polar | 33892256 | 11a-Hydroxyprogesterone,1TMS,isomer #4 | C=C(O[Si](C)(C)C)C1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@H](O)C[C@]12C | 3053.3 | Semi standard non polar | 33892256 | 11a-Hydroxyprogesterone,2TMS,isomer #1 | CC(O[Si](C)(C)C)=C1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@H](O[Si](C)(C)C)C[C@]12C | 3005.4 | Semi standard non polar | 33892256 | 11a-Hydroxyprogesterone,2TMS,isomer #1 | CC(O[Si](C)(C)C)=C1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@H](O[Si](C)(C)C)C[C@]12C | 2898.4 | Standard non polar | 33892256 | 11a-Hydroxyprogesterone,2TMS,isomer #1 | CC(O[Si](C)(C)C)=C1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@H](O[Si](C)(C)C)C[C@]12C | 3264.2 | Standard polar | 33892256 | 11a-Hydroxyprogesterone,2TMS,isomer #2 | CC(=O)C1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C)=CC[C@]4(C)[C@H]3[C@H](O[Si](C)(C)C)C[C@]12C | 2884.9 | Semi standard non polar | 33892256 | 11a-Hydroxyprogesterone,2TMS,isomer #2 | CC(=O)C1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C)=CC[C@]4(C)[C@H]3[C@H](O[Si](C)(C)C)C[C@]12C | 2887.0 | Standard non polar | 33892256 | 11a-Hydroxyprogesterone,2TMS,isomer #2 | CC(=O)C1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C)=CC[C@]4(C)[C@H]3[C@H](O[Si](C)(C)C)C[C@]12C | 3256.7 | Standard polar | 33892256 | 11a-Hydroxyprogesterone,2TMS,isomer #3 | C=C(O[Si](C)(C)C)C1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@H](O[Si](C)(C)C)C[C@]12C | 2973.2 | Semi standard non polar | 33892256 | 11a-Hydroxyprogesterone,2TMS,isomer #3 | C=C(O[Si](C)(C)C)C1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@H](O[Si](C)(C)C)C[C@]12C | 2866.7 | Standard non polar | 33892256 | 11a-Hydroxyprogesterone,2TMS,isomer #3 | C=C(O[Si](C)(C)C)C1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@H](O[Si](C)(C)C)C[C@]12C | 3331.1 | Standard polar | 33892256 | 11a-Hydroxyprogesterone,2TMS,isomer #4 | CC(O[Si](C)(C)C)=C1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C)=CC[C@]4(C)[C@H]3[C@H](O)C[C@]12C | 2977.6 | Semi standard non polar | 33892256 | 11a-Hydroxyprogesterone,2TMS,isomer #4 | CC(O[Si](C)(C)C)=C1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C)=CC[C@]4(C)[C@H]3[C@H](O)C[C@]12C | 2984.7 | Standard non polar | 33892256 | 11a-Hydroxyprogesterone,2TMS,isomer #4 | CC(O[Si](C)(C)C)=C1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C)=CC[C@]4(C)[C@H]3[C@H](O)C[C@]12C | 3273.5 | Standard polar | 33892256 | 11a-Hydroxyprogesterone,2TMS,isomer #5 | C=C(O[Si](C)(C)C)C1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C)=CC[C@]4(C)[C@H]3[C@H](O)C[C@]12C | 2928.5 | Semi standard non polar | 33892256 | 11a-Hydroxyprogesterone,2TMS,isomer #5 | C=C(O[Si](C)(C)C)C1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C)=CC[C@]4(C)[C@H]3[C@H](O)C[C@]12C | 2964.5 | Standard non polar | 33892256 | 11a-Hydroxyprogesterone,2TMS,isomer #5 | C=C(O[Si](C)(C)C)C1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C)=CC[C@]4(C)[C@H]3[C@H](O)C[C@]12C | 3340.7 | Standard polar | 33892256 | 11a-Hydroxyprogesterone,3TMS,isomer #1 | CC(O[Si](C)(C)C)=C1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C)=CC[C@]4(C)[C@H]3[C@H](O[Si](C)(C)C)C[C@]12C | 2871.6 | Semi standard non polar | 33892256 | 11a-Hydroxyprogesterone,3TMS,isomer #1 | CC(O[Si](C)(C)C)=C1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C)=CC[C@]4(C)[C@H]3[C@H](O[Si](C)(C)C)C[C@]12C | 2942.9 | Standard non polar | 33892256 | 11a-Hydroxyprogesterone,3TMS,isomer #1 | CC(O[Si](C)(C)C)=C1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C)=CC[C@]4(C)[C@H]3[C@H](O[Si](C)(C)C)C[C@]12C | 3244.1 | Standard polar | 33892256 | 11a-Hydroxyprogesterone,3TMS,isomer #2 | C=C(O[Si](C)(C)C)C1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C)=CC[C@]4(C)[C@H]3[C@H](O[Si](C)(C)C)C[C@]12C | 2863.1 | Semi standard non polar | 33892256 | 11a-Hydroxyprogesterone,3TMS,isomer #2 | C=C(O[Si](C)(C)C)C1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C)=CC[C@]4(C)[C@H]3[C@H](O[Si](C)(C)C)C[C@]12C | 2931.1 | Standard non polar | 33892256 | 11a-Hydroxyprogesterone,3TMS,isomer #2 | C=C(O[Si](C)(C)C)C1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C)=CC[C@]4(C)[C@H]3[C@H](O[Si](C)(C)C)C[C@]12C | 3298.5 | Standard polar | 33892256 | 11a-Hydroxyprogesterone,1TBDMS,isomer #1 | CC(=O)C1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@H](O[Si](C)(C)C(C)(C)C)C[C@]12C | 3289.5 | Semi standard non polar | 33892256 | 11a-Hydroxyprogesterone,1TBDMS,isomer #2 | CC(O[Si](C)(C)C(C)(C)C)=C1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@H](O)C[C@]12C | 3311.4 | Semi standard non polar | 33892256 | 11a-Hydroxyprogesterone,1TBDMS,isomer #3 | CC(=O)C1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)[C@H]3[C@H](O)C[C@]12C | 3204.0 | Semi standard non polar | 33892256 | 11a-Hydroxyprogesterone,1TBDMS,isomer #4 | C=C(O[Si](C)(C)C(C)(C)C)C1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@H](O)C[C@]12C | 3292.2 | Semi standard non polar | 33892256 | 11a-Hydroxyprogesterone,2TBDMS,isomer #1 | CC(O[Si](C)(C)C(C)(C)C)=C1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@H](O[Si](C)(C)C(C)(C)C)C[C@]12C | 3480.5 | Semi standard non polar | 33892256 | 11a-Hydroxyprogesterone,2TBDMS,isomer #1 | CC(O[Si](C)(C)C(C)(C)C)=C1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@H](O[Si](C)(C)C(C)(C)C)C[C@]12C | 3409.2 | Standard non polar | 33892256 | 11a-Hydroxyprogesterone,2TBDMS,isomer #1 | CC(O[Si](C)(C)C(C)(C)C)=C1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@H](O[Si](C)(C)C(C)(C)C)C[C@]12C | 3501.9 | Standard polar | 33892256 | 11a-Hydroxyprogesterone,2TBDMS,isomer #2 | CC(=O)C1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)[C@H]3[C@H](O[Si](C)(C)C(C)(C)C)C[C@]12C | 3347.9 | Semi standard non polar | 33892256 | 11a-Hydroxyprogesterone,2TBDMS,isomer #2 | CC(=O)C1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)[C@H]3[C@H](O[Si](C)(C)C(C)(C)C)C[C@]12C | 3351.8 | Standard non polar | 33892256 | 11a-Hydroxyprogesterone,2TBDMS,isomer #2 | CC(=O)C1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)[C@H]3[C@H](O[Si](C)(C)C(C)(C)C)C[C@]12C | 3482.3 | Standard polar | 33892256 | 11a-Hydroxyprogesterone,2TBDMS,isomer #3 | C=C(O[Si](C)(C)C(C)(C)C)C1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@H](O[Si](C)(C)C(C)(C)C)C[C@]12C | 3443.5 | Semi standard non polar | 33892256 | 11a-Hydroxyprogesterone,2TBDMS,isomer #3 | C=C(O[Si](C)(C)C(C)(C)C)C1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@H](O[Si](C)(C)C(C)(C)C)C[C@]12C | 3380.4 | Standard non polar | 33892256 | 11a-Hydroxyprogesterone,2TBDMS,isomer #3 | C=C(O[Si](C)(C)C(C)(C)C)C1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@H]3[C@H](O[Si](C)(C)C(C)(C)C)C[C@]12C | 3544.2 | Standard polar | 33892256 | 11a-Hydroxyprogesterone,2TBDMS,isomer #4 | CC(O[Si](C)(C)C(C)(C)C)=C1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)[C@H]3[C@H](O)C[C@]12C | 3455.1 | Semi standard non polar | 33892256 | 11a-Hydroxyprogesterone,2TBDMS,isomer #4 | CC(O[Si](C)(C)C(C)(C)C)=C1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)[C@H]3[C@H](O)C[C@]12C | 3407.2 | Standard non polar | 33892256 | 11a-Hydroxyprogesterone,2TBDMS,isomer #4 | CC(O[Si](C)(C)C(C)(C)C)=C1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)[C@H]3[C@H](O)C[C@]12C | 3512.3 | Standard polar | 33892256 | 11a-Hydroxyprogesterone,2TBDMS,isomer #5 | C=C(O[Si](C)(C)C(C)(C)C)C1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)[C@H]3[C@H](O)C[C@]12C | 3395.0 | Semi standard non polar | 33892256 | 11a-Hydroxyprogesterone,2TBDMS,isomer #5 | C=C(O[Si](C)(C)C(C)(C)C)C1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)[C@H]3[C@H](O)C[C@]12C | 3395.5 | Standard non polar | 33892256 | 11a-Hydroxyprogesterone,2TBDMS,isomer #5 | C=C(O[Si](C)(C)C(C)(C)C)C1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)[C@H]3[C@H](O)C[C@]12C | 3556.9 | Standard polar | 33892256 | 11a-Hydroxyprogesterone,3TBDMS,isomer #1 | CC(O[Si](C)(C)C(C)(C)C)=C1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)[C@H]3[C@H](O[Si](C)(C)C(C)(C)C)C[C@]12C | 3506.3 | Semi standard non polar | 33892256 | 11a-Hydroxyprogesterone,3TBDMS,isomer #1 | CC(O[Si](C)(C)C(C)(C)C)=C1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)[C@H]3[C@H](O[Si](C)(C)C(C)(C)C)C[C@]12C | 3556.0 | Standard non polar | 33892256 | 11a-Hydroxyprogesterone,3TBDMS,isomer #1 | CC(O[Si](C)(C)C(C)(C)C)=C1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)[C@H]3[C@H](O[Si](C)(C)C(C)(C)C)C[C@]12C | 3525.8 | Standard polar | 33892256 | 11a-Hydroxyprogesterone,3TBDMS,isomer #2 | C=C(O[Si](C)(C)C(C)(C)C)C1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)[C@H]3[C@H](O[Si](C)(C)C(C)(C)C)C[C@]12C | 3502.1 | Semi standard non polar | 33892256 | 11a-Hydroxyprogesterone,3TBDMS,isomer #2 | C=C(O[Si](C)(C)C(C)(C)C)C1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)[C@H]3[C@H](O[Si](C)(C)C(C)(C)C)C[C@]12C | 3553.4 | Standard non polar | 33892256 | 11a-Hydroxyprogesterone,3TBDMS,isomer #2 | C=C(O[Si](C)(C)C(C)(C)C)C1CC[C@H]2[C@@H]3CCC4=CC(O[Si](C)(C)C(C)(C)C)=CC[C@]4(C)[C@H]3[C@H](O[Si](C)(C)C(C)(C)C)C[C@]12C | 3544.1 | Standard polar | 33892256 |
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Spectra |
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| GC-MS SpectraSpectrum Type | Description | Splash Key | Deposition Date | Source | View |
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Predicted GC-MS | Predicted GC-MS Spectrum - 11a-Hydroxyprogesterone GC-MS (Non-derivatized) - 70eV, Positive | splash10-060c-1953000000-b1a4b33b602a8015fa69 | 2017-09-01 | Wishart Lab | View Spectrum | Predicted GC-MS | Predicted GC-MS Spectrum - 11a-Hydroxyprogesterone GC-MS (1 TMS) - 70eV, Positive | splash10-00ei-2429000000-079db188a5d002efdb6b | 2017-10-06 | Wishart Lab | View Spectrum | Predicted GC-MS | Predicted GC-MS Spectrum - 11a-Hydroxyprogesterone GC-MS (Non-derivatized) - 70eV, Positive | Not Available | 2021-10-12 | Wishart Lab | View Spectrum | Predicted GC-MS | Predicted GC-MS Spectrum - 11a-Hydroxyprogesterone GC-MS (Non-derivatized) - 70eV, Positive | Not Available | 2021-10-12 | Wishart Lab | View Spectrum | Predicted GC-MS | Predicted GC-MS Spectrum - 11a-Hydroxyprogesterone GC-MS (TMS_1_2) - 70eV, Positive | Not Available | 2021-11-06 | Wishart Lab | View Spectrum | Predicted GC-MS | Predicted GC-MS Spectrum - 11a-Hydroxyprogesterone GC-MS (TMS_1_3) - 70eV, Positive | Not Available | 2021-11-06 | Wishart Lab | View Spectrum | Predicted GC-MS | Predicted GC-MS Spectrum - 11a-Hydroxyprogesterone GC-MS (TMS_1_4) - 70eV, Positive | Not Available | 2021-11-06 | Wishart Lab | View Spectrum | Predicted GC-MS | Predicted GC-MS Spectrum - 11a-Hydroxyprogesterone GC-MS (TBDMS_1_1) - 70eV, Positive | Not Available | 2021-11-06 | Wishart Lab | View Spectrum | Predicted GC-MS | Predicted GC-MS Spectrum - 11a-Hydroxyprogesterone GC-MS (TBDMS_1_2) - 70eV, Positive | Not Available | 2021-11-06 | Wishart Lab | View Spectrum | Predicted GC-MS | Predicted GC-MS Spectrum - 11a-Hydroxyprogesterone GC-MS (TBDMS_1_3) - 70eV, Positive | Not Available | 2021-11-06 | Wishart Lab | View Spectrum | Predicted GC-MS | Predicted GC-MS Spectrum - 11a-Hydroxyprogesterone GC-MS (TBDMS_1_4) - 70eV, Positive | Not Available | 2021-11-06 | Wishart Lab | View Spectrum |
MS/MS SpectraSpectrum Type | Description | Splash Key | Deposition Date | Source | View |
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Experimental LC-MS/MS | LC-MS/MS Spectrum - 11a-Hydroxyprogesterone Quattro_QQQ 10V, Positive-QTOF (Annotated) | splash10-001i-0009000000-3dea6ae65884847d2d23 | 2012-07-24 | HMDB team, MONA | View Spectrum | Experimental LC-MS/MS | LC-MS/MS Spectrum - 11a-Hydroxyprogesterone Quattro_QQQ 25V, Positive-QTOF (Annotated) | splash10-00di-3920000000-f68bb1cfb59fc92b2b29 | 2012-07-24 | HMDB team, MONA | View Spectrum | Experimental LC-MS/MS | LC-MS/MS Spectrum - 11a-Hydroxyprogesterone Quattro_QQQ 40V, Positive-QTOF (Annotated) | splash10-006y-9800000000-c9be24b1a08fbdae7688 | 2012-07-24 | HMDB team, MONA | View Spectrum | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 11a-Hydroxyprogesterone 10V, Positive-QTOF | splash10-03e9-0019000000-bf6b2487f64f20d9b0bc | 2017-09-01 | Wishart Lab | View Spectrum | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 11a-Hydroxyprogesterone 20V, Positive-QTOF | splash10-03ej-0396000000-92a340550f7481b38022 | 2017-09-01 | Wishart Lab | View Spectrum | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 11a-Hydroxyprogesterone 40V, Positive-QTOF | splash10-0zfu-4191000000-1c0ef35ebf478850133d | 2017-09-01 | Wishart Lab | View Spectrum | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 11a-Hydroxyprogesterone 10V, Negative-QTOF | splash10-004i-0009000000-f02ca96a4e201dad8f5f | 2017-09-01 | Wishart Lab | View Spectrum | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 11a-Hydroxyprogesterone 20V, Negative-QTOF | splash10-004i-0019000000-394e7b1e14943d144acf | 2017-09-01 | Wishart Lab | View Spectrum | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 11a-Hydroxyprogesterone 40V, Negative-QTOF | splash10-03dr-1195000000-470cc2622e09566ebf95 | 2017-09-01 | Wishart Lab | View Spectrum | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 11a-Hydroxyprogesterone 10V, Negative-QTOF | splash10-004i-0009000000-3acdbd949ad93c49c37e | 2021-09-24 | Wishart Lab | View Spectrum | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 11a-Hydroxyprogesterone 20V, Negative-QTOF | splash10-004i-0029000000-7853a5e8535805da7f8a | 2021-09-24 | Wishart Lab | View Spectrum | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 11a-Hydroxyprogesterone 40V, Negative-QTOF | splash10-000t-0192000000-a1d7b9a7a78d30b7da27 | 2021-09-24 | Wishart Lab | View Spectrum | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 11a-Hydroxyprogesterone 10V, Positive-QTOF | splash10-001i-0009000000-bbcb8feda689de8948d5 | 2021-09-24 | Wishart Lab | View Spectrum | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 11a-Hydroxyprogesterone 20V, Positive-QTOF | splash10-03ei-1293000000-97a70cab30be8e37a1a0 | 2021-09-24 | Wishart Lab | View Spectrum | Predicted LC-MS/MS | Predicted LC-MS/MS Spectrum - 11a-Hydroxyprogesterone 40V, Positive-QTOF | splash10-08fu-3690000000-bfbef046ba46172a3844 | 2021-09-24 | Wishart Lab | View Spectrum |
NMR SpectraSpectrum Type | Description | Deposition Date | Source | View |
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Experimental 1D NMR | 1H NMR Spectrum (1D, 500 MHz, CDCl3, experimental) | 2012-12-04 | Wishart Lab | View Spectrum | Experimental 2D NMR | [1H, 13C]-HSQC NMR Spectrum (2D, 600 MHz, CDCl3, experimental) | 2012-12-05 | Wishart Lab | View Spectrum |
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Biological Properties |
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Cellular Locations | - Extracellular
- Membrane (predicted from logP)
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Biospecimen Locations | Not Available |
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Tissue Locations | Not Available |
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Pathways | |
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Normal Concentrations |
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| Not Available |
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Abnormal Concentrations |
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| Not Available |
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Associated Disorders and Diseases |
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Disease References | None |
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Associated OMIM IDs | None |
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External Links |
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DrugBank ID | Not Available |
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Phenol Explorer Compound ID | Not Available |
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FooDB ID | FDB022318 |
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KNApSAcK ID | Not Available |
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Chemspider ID | 389106 |
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KEGG Compound ID | C03747 |
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BioCyc ID | Not Available |
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BiGG ID | Not Available |
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Wikipedia Link | Not Available |
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METLIN ID | 5873 |
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PubChem Compound | 440105 |
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PDB ID | Not Available |
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ChEBI ID | 16076 |
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Food Biomarker Ontology | Not Available |
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VMH ID | Not Available |
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MarkerDB ID | Not Available |
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Good Scents ID | Not Available |
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References |
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Synthesis Reference | 11b-Hydroxylation of steroids. (1957), GB 769999 19570313 CAN 51:64205 AN 1957:64205 |
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Material Safety Data Sheet (MSDS) | Not Available |
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General References | - Blau N, Zachmann M, Kempken B, Staudenmann W, Mohr E, Curtius HC: Identification of new steroids in patients with 17 alpha-hydroxylase deficiency by capillary gas chromatography/mass spectrometry. Biomed Environ Mass Spectrom. 1987 Nov;14(11):633-7. [PubMed:2962669 ]
- van der Willigen AH, Peereboom-Wynia JD, van Joost T, Stolz E: A preliminary study of the effect of 11a-hydroxyprogesterone on the hair growth in men suffering from androgenetic alopecia. Acta Derm Venereol. 1987;67(1):82-5. [PubMed:2436423 ]
- Iudaev NA, Afinogenova SA: [Pathways of corticosteroid biosynthesis in human adrenals (Itsenko-Cushing disease)]. Biokhimiia. 1976 Sep;41(9):1619-27. [PubMed:974176 ]
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