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Record Information

Version

5.0

Status

Detected and Quantified

Creation Date

2006-08-13 19:18:32 UTC

Update Date

2023-02-21 17:17:02 UTC

HMDB ID

HMDB0004461

Secondary Accession Numbers

HMDB04461

Metabolite Identification

Common Name

Benzamide

Description

Benzamide, also known as PHC(=o)NH2 or phenylcarboxamide, belongs to the class of organic compounds known as benzamides. These are organic compounds containing a carboxamido substituent attached to a benzene ring. Benzamide exists in all living organisms, ranging from bacteria to humans. Benzamide is a bitter tasting compound. Benzamide has been detected, but not quantified in, a few different foods, such as anatidaes (Anatidae), chickens (Gallus gallus), and domestic pigs (Sus scrofa domestica). This could make benzamide a potential biomarker for the consumption of these foods. Benzamide is a primary metabolite. Primary metabolites are metabolically or physiologically essential metabolites. They are directly involved in an organism’s growth, development or reproduction. Based on a literature review a significant number of articles have been published on Benzamide.

Structure

MOL 3D MOL SDF 3D SDF PDB 3D PDB SMILES InChI

View in JSmol View NMR Assignments View Stereo Labels

Synonyms

Value	Source
Benzenecarboxamide	ChEBI
Benzoic acid amide	ChEBI
Benzoylamide	ChEBI
PHC(=O)NH2	ChEBI
PHC(O)NH2	ChEBI
Phenylcarboxamide	ChEBI
Phenylcarboxyamide	ChEBI
Benzoate amide	Generator
Amid kyseliny benzoove	HMDB
Benzamide (acd/name 4.0)	HMDB
Benzoate	HMDB
Benzoic acid	HMDB
Phenyl carboxyamide	HMDB
Tigan	HMDB
Trimethobenzamide hydrochloride	HMDB

Chemical Formula

C₇H₇NO

Average Molecular Weight

121.1366

Monoisotopic Molecular Weight

121.052763851

IUPAC Name

benzamide

Traditional Name

benzamide

CAS Registry Number

55-21-0

SMILES

NC(=O)C1=CC=CC=C1

InChI Identifier

InChI=1S/C7H7NO/c8-7(9)6-4-2-1-3-5-6/h1-5H,(H2,8,9)

InChI Key

KXDAEFPNCMNJSK-UHFFFAOYSA-N

Chemical Taxonomy

Description

Belongs to the class of organic compounds known as benzamides. These are organic compounds containing a carboxamido substituent attached to a benzene ring.

Kingdom

Organic compounds

Super Class

Benzenoids

Class

Benzene and substituted derivatives

Sub Class

Benzoic acids and derivatives

Direct Parent

Benzamides

Alternative Parents

Substituents

Benzamide
Benzoyl
Primary carboxylic acid amide
Carboxamide group
Carboxylic acid derivative
Organic nitrogen compound
Organic oxygen compound
Organopnictogen compound
Organic oxide
Hydrocarbon derivative
Organooxygen compound
Organonitrogen compound
Aromatic homomonocyclic compound

Molecular Framework

Aromatic homomonocyclic compounds

External Descriptors

benzamides (CHEBI:28179 )

Ontology

Physiological effect

Organoleptic effect

Taste

Bitter

Disposition

Biological location

Non-excretory biofluid

Biofluid or Excreta

Saliva (HMDB: HMDB0004461)
Blood (HMDB: HMDB0004461)

Source

Endogenous

Endogenous (HMDB: HMDB0004461)

Pheasant (FooDB: FOOD00430)
Squab (FooDB: FOOD00481)
Turkey (FooDB: FOOD00494)
Quail (FooDB: FOOD00541)
Anatidae (FooDB: FOOD00576)
Rock ptarmigan (FooDB: FOOD00597)
Columbidae (Dove, Pigeon) (FooDB: FOOD00610)
Chicken (FooDB: FOOD00329)
Mallard duck (FooDB: FOOD00353)
Emu (FooDB: FOOD00360)
Greylag goose (FooDB: FOOD00368)
Guinea hen (FooDB: FOOD00373)
Ostrich (FooDB: FOOD00422)
Velvet duck (FooDB: FOOD00427)

Lagomorph

Ovis

Sheep (Mutton, Lamb) (FooDB: FOOD00473)

Bovine

Venison

Deer (FooDB: FOOD00524)
Mule deer (FooDB: FOOD00348)
Elk (FooDB: FOOD00359)

Caprae

Domestic goat (FooDB: FOOD00529)

Swine

Domestic pig (FooDB: FOOD00536)
Wild boar (FooDB: FOOD00307)

Equine

Horse (FooDB: FOOD00378)

Process

Not Available

Role

Not Available

Physical Properties

State

Solid

Experimental Molecular Properties

Property	Value	Reference
Melting Point	129.1 °C	Not Available
Boiling Point	290.00 °C. @ 760.00 mm Hg	The Good Scents Company Information System
Water Solubility	13500 mg/L at 25 °C	Not Available
LogP	0.818	Not Available

Experimental Chromatographic Properties

Not Available

Predicted Molecular Properties

Property	Value	Source
Water Solubility	8.77 g/L	ALOGPS
logP	0.51	ALOGPS
logP	0.82	ChemAxon
logS	-1.1	ALOGPS
pKa (Strongest Acidic)	14.56	ChemAxon
pKa (Strongest Basic)	-1.2	ChemAxon
Physiological Charge	0	ChemAxon
Hydrogen Acceptor Count	1	ChemAxon
Hydrogen Donor Count	1	ChemAxon
Polar Surface Area	43.09 Å²	ChemAxon
Rotatable Bond Count	1	ChemAxon
Refractivity	35.14 m³·mol⁻¹	ChemAxon
Polarizability	12.38 Å³	ChemAxon
Number of Rings	1	ChemAxon
Bioavailability	Yes	ChemAxon
Rule of Five	Yes	ChemAxon
Ghose Filter	No	ChemAxon
Veber's Rule	No	ChemAxon
MDDR-like Rule	No	ChemAxon

Predicted Chromatographic Properties

Predicted Collision Cross Sections

Predictor	Adduct Type	CCS Value (Å²)	Reference
DarkChem	[M+H]+	124.774	31661259
DarkChem	[M-H]-	118.136	31661259
DeepCCS	[M+H]+	124.253	30932474
DeepCCS	[M-H]-	120.95	30932474
DeepCCS	[M-2H]-	157.986	30932474
DeepCCS	[M+Na]+	133.064	30932474
AllCCS	[M+H]+	125.2	32859911
AllCCS	[M+H-H2O]+	120.3	32859911
AllCCS	[M+NH4]+	129.7	32859911
AllCCS	[M+Na]+	131.0	32859911
AllCCS	[M-H]-	121.9	32859911
AllCCS	[M+Na-2H]-	124.0	32859911
AllCCS	[M+HCOO]-	126.2	32859911

Predicted Kovats Retention Indices

Underivatized

Metabolite	SMILES	Kovats RI Value	Column Type	Reference
Benzamide	NC(=O)C1=CC=CC=C1	2460.3	Standard polar	33892256
Benzamide	NC(=O)C1=CC=CC=C1	1172.6	Standard non polar	33892256
Benzamide	NC(=O)C1=CC=CC=C1	1356.2	Semi standard non polar	33892256

Derivatized

Derivative Name / Structure	SMILES	Kovats RI Value	Column Type	Reference
Benzamide,1TMS,isomer #1	C[Si](C)(C)NC(=O)C1=CC=CC=C1	1406.7	Semi standard non polar	33892256
Benzamide,1TMS,isomer #1	C[Si](C)(C)NC(=O)C1=CC=CC=C1	1441.8	Standard non polar	33892256
Benzamide,1TMS,isomer #1	C[Si](C)(C)NC(=O)C1=CC=CC=C1	1665.3	Standard polar	33892256
Benzamide,2TMS,isomer #1	C[Si](C)(C)N(C(=O)C1=CC=CC=C1)[Si](C)(C)C	1483.9	Semi standard non polar	33892256
Benzamide,2TMS,isomer #1	C[Si](C)(C)N(C(=O)C1=CC=CC=C1)[Si](C)(C)C	1522.4	Standard non polar	33892256
Benzamide,2TMS,isomer #1	C[Si](C)(C)N(C(=O)C1=CC=CC=C1)[Si](C)(C)C	1652.6	Standard polar	33892256
Benzamide,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NC(=O)C1=CC=CC=C1	1637.0	Semi standard non polar	33892256
Benzamide,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NC(=O)C1=CC=CC=C1	1608.4	Standard non polar	33892256
Benzamide,1TBDMS,isomer #1	CC(C)(C)[Si](C)(C)NC(=O)C1=CC=CC=C1	1834.9	Standard polar	33892256
Benzamide,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)N(C(=O)C1=CC=CC=C1)[Si](C)(C)C(C)(C)C	1910.4	Semi standard non polar	33892256
Benzamide,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)N(C(=O)C1=CC=CC=C1)[Si](C)(C)C(C)(C)C	1918.1	Standard non polar	33892256
Benzamide,2TBDMS,isomer #1	CC(C)(C)[Si](C)(C)N(C(=O)C1=CC=CC=C1)[Si](C)(C)C(C)(C)C	1902.7	Standard polar	33892256

Spectra

GC-MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Experimental GC-MS	GC-MS Spectrum - Benzamide EI-B (Non-derivatized)	splash10-0ab9-2900000000-d10a8514e7c0dedd5758	2017-09-12	HMDB team, MONA, MassBank	View Spectrum
Experimental GC-MS	GC-MS Spectrum - Benzamide EI-B (Non-derivatized)	splash10-0kk9-8900000000-a6264ed866860ca71f94	2017-09-12	HMDB team, MONA, MassBank	View Spectrum
Experimental GC-MS	GC-MS Spectrum - Benzamide EI-B (Non-derivatized)	splash10-0adi-7900000000-c79bab8ceedf3b276ae1	2017-09-12	HMDB team, MONA, MassBank	View Spectrum
Experimental GC-MS	GC-MS Spectrum - Benzamide GC-EI-TOF (Non-derivatized)	splash10-0fbi-0900000000-e11c600f209e5f1be1fd	2017-09-12	HMDB team, MONA, MassBank	View Spectrum
Experimental GC-MS	GC-MS Spectrum - Benzamide EI-B (Non-derivatized)	splash10-0ab9-2900000000-d10a8514e7c0dedd5758	2018-05-18	HMDB team, MONA, MassBank	View Spectrum
Experimental GC-MS	GC-MS Spectrum - Benzamide EI-B (Non-derivatized)	splash10-0kk9-8900000000-a6264ed866860ca71f94	2018-05-18	HMDB team, MONA, MassBank	View Spectrum
Experimental GC-MS	GC-MS Spectrum - Benzamide EI-B (Non-derivatized)	splash10-0adi-7900000000-c79bab8ceedf3b276ae1	2018-05-18	HMDB team, MONA, MassBank	View Spectrum
Experimental GC-MS	GC-MS Spectrum - Benzamide GC-EI-TOF (Non-derivatized)	splash10-0fbi-0900000000-e11c600f209e5f1be1fd	2018-05-18	HMDB team, MONA, MassBank	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Benzamide GC-MS (Non-derivatized) - 70eV, Positive	splash10-0pi0-4900000000-24e0b6bee128508783c3	2017-09-01	Wishart Lab	View Spectrum
Predicted GC-MS	Predicted GC-MS Spectrum - Benzamide GC-MS (Non-derivatized) - 70eV, Positive	Not Available	2021-10-12	Wishart Lab	View Spectrum

MS/MS Spectra

Spectrum Type	Description	Splash Key	Deposition Date	Source	View
Experimental LC-MS/MS	LC-MS/MS Spectrum - Benzamide Quattro_QQQ 10V, Positive-QTOF (Annotated)	splash10-00fr-3900000000-274cc52f0c0c8accad8c	2012-07-25	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Benzamide Quattro_QQQ 25V, Positive-QTOF (Annotated)	splash10-0fb9-9400000000-53a105851fb3f3bfa447	2012-07-25	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Benzamide Quattro_QQQ 40V, Positive-QTOF (Annotated)	splash10-0fb9-9000000000-3fd0ac2c3e583778d4f7	2012-07-25	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Benzamide EI-B (HITACHI M-80) , Positive-QTOF	splash10-0ab9-2900000000-d10a8514e7c0dedd5758	2012-08-31	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Benzamide EI-B (HITACHI RMU-7M) , Positive-QTOF	splash10-0kk9-8900000000-6e34f51843ee9cdd8237	2012-08-31	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Benzamide LC-ESI-QQ (API3000, Applied Biosystems) 10V, Positive-QTOF	splash10-00di-1900000000-b21069169eafde58c822	2012-08-31	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Benzamide LC-ESI-QQ (API3000, Applied Biosystems) 20V, Positive-QTOF	splash10-0a6r-8900000000-85f7934fa93d7240804f	2012-08-31	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Benzamide LC-ESI-QQ (API3000, Applied Biosystems) 30V, Positive-QTOF	splash10-004i-9200000000-e4b0272643ae9f111021	2012-08-31	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Benzamide LC-ESI-QQ (API3000, Applied Biosystems) 40V, Positive-QTOF	splash10-004i-9100000000-c34f0e594deb730ca6b7	2012-08-31	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Benzamide LC-ESI-QQ (API3000, Applied Biosystems) 50V, Positive-QTOF	splash10-0fb9-9100000000-76a5adf911f1a97ad45b	2012-08-31	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Benzamide LC-ESI-QQ , positive-QTOF	splash10-00di-1900000000-c6e30a6a9805ba36fc2a	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Benzamide LC-ESI-QQ , positive-QTOF	splash10-0a6r-8900000000-d40d6a968a8a706e6500	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Benzamide LC-ESI-QQ , positive-QTOF	splash10-004i-9200000000-e4b0272643ae9f111021	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Benzamide LC-ESI-QQ , positive-QTOF	splash10-004i-9100000000-c34f0e594deb730ca6b7	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Benzamide LC-ESI-QQ , positive-QTOF	splash10-0fb9-9100000000-76a5adf911f1a97ad45b	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Benzamide LC-ESI-QFT , positive-QTOF	splash10-05i0-3900000000-105f114ff019238e0401	2017-09-14	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Benzamide 35V, Positive-QTOF	splash10-004l-9200000000-8469324285df124d1be3	2021-09-20	HMDB team, MONA	View Spectrum
Experimental LC-MS/MS	LC-MS/MS Spectrum - Benzamide 35V, Positive-QTOF	splash10-05i0-3900000000-d11c117a49a854420bb8	2021-09-20	HMDB team, MONA	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Benzamide 10V, Positive-QTOF	splash10-00di-0900000000-b10777bbfb9e15c822c0	2015-04-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Benzamide 20V, Positive-QTOF	splash10-00di-4900000000-4401050524c9108d0e36	2015-04-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Benzamide 40V, Positive-QTOF	splash10-0udi-9600000000-a2aca9e73b19fc5335b3	2015-04-24	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Benzamide 10V, Negative-QTOF	splash10-00di-1900000000-cb7510152a09599b3704	2015-04-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Benzamide 20V, Negative-QTOF	splash10-00fr-6900000000-4e21f69e91793514c49e	2015-04-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Benzamide 40V, Negative-QTOF	splash10-0006-9000000000-a5e23c6893e288e53794	2015-04-25	Wishart Lab	View Spectrum
Predicted LC-MS/MS	Predicted LC-MS/MS Spectrum - Benzamide 10V, Positive-QTOF	splash10-05fr-1900000000-2bb0f9ac1f4add8c0853	2021-09-23	Wishart Lab	View Spectrum

NMR Spectra

Spectrum Type	Description	Deposition Date	Source	View
Predicted 1D NMR	¹H NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 100 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 1000 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 200 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 300 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 400 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 500 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 600 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 700 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 800 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹H NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum
Predicted 1D NMR	¹³C NMR Spectrum (1D, 900 MHz, D₂O, predicted)	2021-09-24	Wishart Lab	View Spectrum

IR Spectra

Spectrum Type	Description	Deposition Date	Source	View
Predicted IR Spectrum	IR Ion Spectrum (Predicted IRIS Spectrum, Adduct: [M-H]-)	2023-02-03	FELIX lab	View Spectrum
Predicted IR Spectrum	IR Ion Spectrum (Predicted IRIS Spectrum, Adduct: [M+H]+)	2023-02-03	FELIX lab	View Spectrum
Predicted IR Spectrum	IR Ion Spectrum (Predicted IRIS Spectrum, Adduct: [M+Na]+)	2023-02-03	FELIX lab	View Spectrum

Biological Properties

Cellular Locations

Not Available

Biospecimen Locations

Blood
Saliva
Urine

Tissue Locations

Not Available

Pathways

Not Available

Name	SMPDB/PathBank	KEGG

Normal Concentrations

Biospecimen	Status	Value	Age	Sex	Condition	Reference	Details
Saliva	Detected and Quantified	0.151 +/- 8.15 uM	Adult (>18 years old)	Both	Normal	Sugimoto et al. (...	details
Saliva	Detected and Quantified	24.3 +/- 12.3 uM	Adult (>18 years old)	Female	Normal	Sugimoto et al. (...	details

Abnormal Concentrations

Biospecimen	Status	Value	Age	Sex	Condition	Reference	Details
Blood	Expected but not Quantified	Not Quantified	Not Specified	Not Specified	Cancer patients undergoing total body irradiation	31424920	details
Saliva	Detected and Quantified	24.7 +/- 12.7 uM	Adult (>18 years old)	Both	Dental caries	Sugimoto et al. (...	details
Urine	Detected but not Quantified	Not Quantified	Not Specified	Not Specified	Cancer patients undergoing total body irradiation	31424920	details

Associated Disorders and Diseases

Disease References

None

Associated OMIM IDs

None

External Links

DrugBank ID

Not Available

Phenol Explorer Compound ID

Not Available

FooDB ID

KNApSAcK ID

Chemspider ID

KEGG Compound ID

BioCyc ID

BiGG ID

Not Available

Wikipedia Link

Benzamide

METLIN ID

Not Available

PubChem Compound

2331

PDB ID

UNU

ChEBI ID

28179

Food Biomarker Ontology

Not Available

VMH ID

BZAM

MarkerDB ID

Not Available

Good Scents ID

rw1221711

References

Synthesis Reference

Not Available

Material Safety Data Sheet (MSDS)

Not Available

General References

Chemnitius JM, Haselmeyer KH, Gonska BD, Kreuzer H, Zech R: Indirect parasympathomimetic activity of metoclopramide: reversible inhibition of cholinesterases from human central nervous system and blood. Pharmacol Res. 1996 Jul-Aug;34(1-2):65-72. [PubMed:8981558 ]
Coyle JD, MacKichan JJ, Boudoulas H, Lima JJ: Reversed-phase liquid chromatography method for measurement of procainamide and three metabolites in serum and urine: percent of dose excreted as deethyl metabolites. J Pharm Sci. 1987 May;76(5):402-5. [PubMed:2443639 ]
Chiba R, Ogasawara A, Kubo T, Yamazaki H, Umino M, Ishizuka Y: Direct determination of benzamides in serum by column-switching high-performance liquid chromatography. Anal Sci. 2003 May;19(5):785-9. [PubMed:12769385 ]
Yamamoto T, Hanioka N, Maeda Y, Imazumi K, Hamada K, Matsuo M, Manda T, Mutoh S: Contribution of tachykinin receptor subtypes to micturition reflex in guinea pigs. Eur J Pharmacol. 2003 Sep 23;477(3):253-9. [PubMed:14522364 ]
Gschwend MH, Arnold P, Ring J, Martin W: Selective and sensitive determination of amisulpride in human plasma by liquid chromatography-tandem mass spectrometry with positive electrospray ionisation and multiple reaction monitoring. J Chromatogr B Analyt Technol Biomed Life Sci. 2006 Feb 2;831(1-2):132-9. Epub 2005 Dec 28. [PubMed:16386474 ]
de Jong AP, Wittebrood AJ, du Chatinier WM, Bron J: Liquid chromatographic analysis of alizapride and metoclopramide in human plasma and urine using solid-phase extraction. J Chromatogr. 1987 Aug 7;419:233-42. [PubMed:3667781 ]
Jitsufuchi N, Kudo K, Tokunaga H, Imamura T: Selective determination of sultopride in human plasma using high-performance liquid chromatography with ultraviolet detection and particle beam mass spectrometry. J Chromatogr B Biomed Sci Appl. 1997 Mar 7;690(1-2):153-9. [PubMed:9106039 ]
Delarue C, Contesse V, Lefebvre H, Lenglet S, Grumolato L, Kuhn JM, Vaudry H: Pharmacological profile of serotonergic receptors in the adrenal gland. Endocr Res. 1998 Aug-Nov;24(3-4):687-94. [PubMed:9888560 ]

Showing metabocard for Benzamide (HMDB0004461)

MOL for HMDB0004461 (Benzamide)

3D MOL for HMDB0004461 (Benzamide)

3D SDF for HMDB0004461 (Benzamide)

3D-SDF for HMDB0004461 (Benzamide)

PDB for HMDB0004461 (Benzamide)

3D PDB for HMDB0004461 (Benzamide)

SMILES for HMDB0004461 (Benzamide)

INCHI for HMDB0004461 (Benzamide)

Structure for HMDB0004461 (Benzamide)

3D Structure for HMDB0004461 (Benzamide)

Predicted Collision Cross Sections

Predicted Kovats Retention Indices

Underivatized

Derivatized

GC-MS Spectra

MS/MS Spectra

NMR Spectra

IR Spectra