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Showing metabocard for Porphobilinogen (HMDB0000245)

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IdentificationTaxonomyOntologyPhysical propertiesSpectraBiological propertiesConcentrationsLinksReferencesenzymes (2) Show 2 proteinsXML
enzymes (2) Show 2 proteins
Record Information
Version5.0
StatusDetected and Quantified
Creation Date2005-11-16 15:48:42 UTC
Update Date2020-10-09 21:08:42 UTC
HMDB IDHMDB0000245
Secondary Accession Numbers
  • HMDB00245
Metabolite Identification
Common NamePorphobilinogen
DescriptionPorphobilinogen (PBG) is a pyrrole-containing intermediate in the biosynthesis of porphyrins. It is generated from aminolevulinate (ALA) by the enzyme ALA dehydratase. Porphobilinogen is then converted into hydroxymethylbilane by the enzyme porphobilinogen deaminase (also known as hydroxymethylbilane synthase). Under certain conditions, porphobilinogen can act as a phototoxin, a neurotoxin, and a metabotoxin. A phototoxin leads to cell damage upon exposure to light. A neurotoxin causes damage to nerve cells and nerve tissues. A metabotoxin is an endogenously produced metabolite that causes adverse health effects at chronically high levels. Chronically high levels of porphyrins are associated with porphyrias such as porphyria variegate, acute intermittent porphyria, and hereditary coproporphyria (HCP). There are several types of porphyrias (most are inherited). Hepatic porphyrias are characterized by acute neurological attacks (seizures, psychosis, extreme back and abdominal pain, and an acute polyneuropathy), while the erythropoietic forms present with skin problems (usually a light-sensitive blistering rash and increased hair growth). The neurotoxicity of porphyrins may be due to their selective interactions with tubulin, which disrupt microtubule formation and cause neural malformations (PMID: 3441503 ).
Structure
Data?1582752118
MOL3D MOLSDF3D SDFPDB3D PDBSMILESInChI

MOL for HMDB0000245 (Porphobilinogen)


  Mrv1652309032023582D          

 16 16  0  0  0  0            999 V2000
 9998.5088 9999.2200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9997.7953 9999.6341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9997.0801 9999.2200    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 9997.795310000.4597    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10000.7728 9999.2200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10001.4898 9999.6341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10002.2048 9999.2200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10002.9198 9999.6341    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10002.2048 9998.3941    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 9998.273010000.8192    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9998.273010001.6458    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
 9999.653110000.9003    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
 9998.985710000.4153    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9999.2406 9999.6307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10000.0656 9999.6307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10000.320510000.4153    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  2  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  2  0  0  0  0
 10 11  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 12 13  1  0  0  0  0
 12 16  1  0  0  0  0
  1 14  1  0  0  0  0
 15  5  1  0  0  0  0
 13 10  1  0  0  0  0
M  END
Download

3D MOL for HMDB0000245 (Porphobilinogen)

HMDB0000245
     RDKit          3D
Porphobilinogen
 30 30  0  0  0  0  0  0  0  0999 V2000
   -3.9164   -1.4425    0.2449 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7954   -1.2230   -0.5285 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4073   -1.2023    0.1172 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6947   -2.1037    0.6901 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5998   -1.6640    0.8588 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6882   -0.4106    0.3496 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8620    0.4735    0.0340 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1795   -0.1118    0.4234 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2164    0.6146   -0.4316 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7950    1.0909   -1.5364 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4958    0.7384   -0.0777 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5522   -0.0986   -0.1044 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0848    1.1685   -0.6038 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0802    1.6673    0.4543 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3393    1.0868    1.5125 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7176    2.8498    0.2446 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5330   -2.2451    0.1417 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6182   -0.5724    0.0199 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8219   -0.6435   -1.4686 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6559   -2.3337   -1.0941 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9634   -3.0782    1.0027 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4498   -2.1771    1.3281 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6476    1.4210    0.6265 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8299    0.7737   -1.0205 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4514    0.0627    1.5221 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2413   -1.1635    0.2193 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9860    1.6289    0.1174 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2550    1.9669   -0.5588 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5215    1.2510   -1.5717 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4858    3.6757   -0.1783 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  2  0
  9 11  1  0
  6 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  2  0
 14 16  1  0
 12  3  2  0
  1 17  1  0
  1 18  1  0
  2 19  1  0
  2 20  1  0
  4 21  1  0
  5 22  1  0
  7 23  1  0
  7 24  1  0
  8 25  1  0
  8 26  1  0
 11 27  1  0
 13 28  1  0
 13 29  1  0
 16 30  1  0
M  END
Download

3D SDF for HMDB0000245 (Porphobilinogen)


  Mrv1652309032023582D          

 16 16  0  0  0  0            999 V2000
 9998.5088 9999.2200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9997.7953 9999.6341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9997.0801 9999.2200    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 9997.795310000.4597    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10000.7728 9999.2200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10001.4898 9999.6341    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10002.2048 9999.2200    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10002.9198 9999.6341    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
10002.2048 9998.3941    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
 9998.273010000.8192    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9998.273010001.6458    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
 9999.653110000.9003    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
 9998.985710000.4153    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
 9999.2406 9999.6307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10000.0656 9999.6307    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
10000.320510000.4153    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0  0  0  0
  2  3  1  0  0  0  0
  2  4  2  0  0  0  0
  5  6  1  0  0  0  0
  6  7  1  0  0  0  0
  7  8  1  0  0  0  0
  7  9  2  0  0  0  0
 10 11  1  0  0  0  0
 13 14  2  0  0  0  0
 14 15  1  0  0  0  0
 15 16  2  0  0  0  0
 12 13  1  0  0  0  0
 12 16  1  0  0  0  0
  1 14  1  0  0  0  0
 15  5  1  0  0  0  0
 13 10  1  0  0  0  0
M  END
> <DATABASE_ID>
HMDB0000245

> <DATABASE_NAME>
hmdb

> <SMILES>
NCC1=C(CC(O)=O)C(CCC(O)=O)=CN1

> <INCHI_IDENTIFIER>
InChI=1S/C10H14N2O4/c11-4-8-7(3-10(15)16)6(5-12-8)1-2-9(13)14/h5,12H,1-4,11H2,(H,13,14)(H,15,16)

> <INCHI_KEY>
QSHWIQZFGQKFMA-UHFFFAOYSA-N

> <FORMULA>
C10H14N2O4

> <MOLECULAR_WEIGHT>
226.2292

> <EXACT_MASS>
226.095356946

> <JCHEM_ACCEPTOR_COUNT>
5

> <JCHEM_ATOM_COUNT>
30

> <JCHEM_AVERAGE_POLARIZABILITY>
22.557878019255046

> <JCHEM_BIOAVAILABILITY>
1

> <JCHEM_DONOR_COUNT>
4

> <JCHEM_FORMAL_CHARGE>
0

> <JCHEM_GHOSE_FILTER>
0

> <JCHEM_IUPAC>
3-[5-(aminomethyl)-4-(carboxymethyl)-1H-pyrrol-3-yl]propanoic acid

> <ALOGPS_LOGP>
-2.40

> <JCHEM_LOGP>
-2.6797758986088773

> <ALOGPS_LOGS>
-1.92

> <JCHEM_MDDR_LIKE_RULE>
0

> <JCHEM_NUMBER_OF_RINGS>
1

> <JCHEM_PHYSIOLOGICAL_CHARGE>
-1

> <JCHEM_PKA>
4.3999884503565605

> <JCHEM_PKA_STRONGEST_ACIDIC>
3.6647253376201103

> <JCHEM_PKA_STRONGEST_BASIC>
8.782950994059014

> <JCHEM_POLAR_SURFACE_AREA>
116.41

> <JCHEM_REFRACTIVITY>
56.3839

> <JCHEM_ROTATABLE_BOND_COUNT>
6

> <JCHEM_RULE_OF_FIVE>
1

> <ALOGPS_SOLUBILITY>
2.72e+00 g/l

> <JCHEM_TRADITIONAL_IUPAC>
porphobilinogen

> <JCHEM_VEBER_RULE>
0

$$$$
Download

3D-SDF for HMDB0000245 (Porphobilinogen)

HMDB0000245
     RDKit          3D
Porphobilinogen
 30 30  0  0  0  0  0  0  0  0999 V2000
   -3.9164   -1.4425    0.2449 N   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7954   -1.2230   -0.5285 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4073   -1.2023    0.1172 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6947   -2.1037    0.6901 N   0  0  0  0  0  0  0  0  0  0  0  0
    0.5998   -1.6640    0.8588 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.6882   -0.4106    0.3496 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8620    0.4735    0.0340 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1795   -0.1118    0.4234 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2164    0.6146   -0.4316 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7950    1.0909   -1.5364 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.4958    0.7384   -0.0777 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5522   -0.0986   -0.1044 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0848    1.1685   -0.6038 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0802    1.6673    0.4543 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3393    1.0868    1.5125 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7176    2.8498    0.2446 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5330   -2.2451    0.1417 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6182   -0.5724    0.0199 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8219   -0.6435   -1.4686 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6559   -2.3337   -1.0941 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9634   -3.0782    1.0027 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4498   -2.1771    1.3281 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6476    1.4210    0.6265 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8299    0.7737   -1.0205 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4514    0.0627    1.5221 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2413   -1.1635    0.2193 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9860    1.6289    0.1174 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2550    1.9669   -0.5588 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5215    1.2510   -1.5717 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4858    3.6757   -0.1783 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  2  0
  9 11  1  0
  6 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  2  0
 14 16  1  0
 12  3  2  0
  1 17  1  0
  1 18  1  0
  2 19  1  0
  2 20  1  0
  4 21  1  0
  5 22  1  0
  7 23  1  0
  7 24  1  0
  8 25  1  0
  8 26  1  0
 11 27  1  0
 13 28  1  0
 13 29  1  0
 16 30  1  0
M  END
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PDB for HMDB0000245 (Porphobilinogen)

HEADER    PROTEIN                                 03-SEP-20   NONE
TITLE     NULL                                                        
COMPND    NULL                                                        
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   03-SEP-20         0                                  
HETATM    1  C   UNK     0    8663.8838665.211   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0    8662.5518665.984   0.000  0.00  0.00           C+0
HETATM    3  O   UNK     0    8661.2168665.211   0.000  0.00  0.00           O+0
HETATM    4  O   UNK     0    8662.5518667.525   0.000  0.00  0.00           O+0
HETATM    5  C   UNK     0    8668.1098665.211   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0    8669.4488665.984   0.000  0.00  0.00           C+0
HETATM    7  C   UNK     0    8670.7828665.211   0.000  0.00  0.00           C+0
HETATM    8  O   UNK     0    8672.1178665.984   0.000  0.00  0.00           O+0
HETATM    9  O   UNK     0    8670.7828663.669   0.000  0.00  0.00           O+0
HETATM   10  C   UNK     0    8663.4438668.196   0.000  0.00  0.00           C+0
HETATM   11  N   UNK     0    8663.4438669.739   0.000  0.00  0.00           N+0
HETATM   12  N   UNK     0    8666.0198668.347   0.000  0.00  0.00           N+0
HETATM   13  C   UNK     0    8664.7738667.442   0.000  0.00  0.00           C+0
HETATM   14  C   UNK     0    8665.2498665.977   0.000  0.00  0.00           C+0
HETATM   15  C   UNK     0    8666.7898665.977   0.000  0.00  0.00           C+0
HETATM   16  C   UNK     0    8667.2658667.442   0.000  0.00  0.00           C+0
CONECT    1    2   14                                                       
CONECT    2    1    3    4                                                  
CONECT    3    2                                                            
CONECT    4    2                                                            
CONECT    5    6   15                                                       
CONECT    6    5    7                                                       
CONECT    7    6    8    9                                                  
CONECT    8    7                                                            
CONECT    9    7                                                            
CONECT   10   11   13                                                       
CONECT   11   10                                                            
CONECT   12   13   16                                                       
CONECT   13   14   12   10                                                  
CONECT   14   13   15    1                                                  
CONECT   15   14   16    5                                                  
CONECT   16   15   12                                                       
MASTER        0    0    0    0    0    0    0    0   16    0   32    0
END
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3D PDB for HMDB0000245 (Porphobilinogen)

COMPND    HMDB0000245
HETATM    1  N1  UNL     1      -3.916  -1.443   0.245  1.00  0.00           N  
HETATM    2  C1  UNL     1      -2.795  -1.223  -0.529  1.00  0.00           C  
HETATM    3  C2  UNL     1      -1.407  -1.202   0.117  1.00  0.00           C  
HETATM    4  N2  UNL     1      -0.695  -2.104   0.690  1.00  0.00           N  
HETATM    5  C3  UNL     1       0.600  -1.664   0.859  1.00  0.00           C  
HETATM    6  C4  UNL     1       0.688  -0.411   0.350  1.00  0.00           C  
HETATM    7  C5  UNL     1       1.862   0.474   0.034  1.00  0.00           C  
HETATM    8  C6  UNL     1       3.179  -0.112   0.423  1.00  0.00           C  
HETATM    9  C7  UNL     1       4.216   0.615  -0.432  1.00  0.00           C  
HETATM   10  O1  UNL     1       3.795   1.091  -1.536  1.00  0.00           O  
HETATM   11  O2  UNL     1       5.496   0.738  -0.078  1.00  0.00           O  
HETATM   12  C8  UNL     1      -0.552  -0.099  -0.104  1.00  0.00           C  
HETATM   13  C9  UNL     1      -1.085   1.169  -0.604  1.00  0.00           C  
HETATM   14  C10 UNL     1      -2.080   1.667   0.454  1.00  0.00           C  
HETATM   15  O3  UNL     1      -2.339   1.087   1.513  1.00  0.00           O  
HETATM   16  O4  UNL     1      -2.718   2.850   0.245  1.00  0.00           O  
HETATM   17  H1  UNL     1      -4.533  -2.245   0.142  1.00  0.00           H  
HETATM   18  H2  UNL     1      -4.618  -0.572   0.020  1.00  0.00           H  
HETATM   19  H3  UNL     1      -2.822  -0.643  -1.469  1.00  0.00           H  
HETATM   20  H4  UNL     1      -2.656  -2.334  -1.094  1.00  0.00           H  
HETATM   21  H5  UNL     1      -0.963  -3.078   1.003  1.00  0.00           H  
HETATM   22  H6  UNL     1       1.450  -2.177   1.328  1.00  0.00           H  
HETATM   23  H7  UNL     1       1.648   1.421   0.627  1.00  0.00           H  
HETATM   24  H8  UNL     1       1.830   0.774  -1.020  1.00  0.00           H  
HETATM   25  H9  UNL     1       3.451   0.063   1.522  1.00  0.00           H  
HETATM   26  H10 UNL     1       3.241  -1.163   0.219  1.00  0.00           H  
HETATM   27  H11 UNL     1       5.986   1.629   0.117  1.00  0.00           H  
HETATM   28  H12 UNL     1      -0.255   1.967  -0.559  1.00  0.00           H  
HETATM   29  H13 UNL     1      -1.522   1.251  -1.572  1.00  0.00           H  
HETATM   30  H14 UNL     1      -2.486   3.676  -0.178  1.00  0.00           H  
CONECT    1    2   17   18
CONECT    2    3   19   20
CONECT    3    4   12   12
CONECT    4    5   21
CONECT    5    6    6   22
CONECT    6    7   12
CONECT    7    8   23   24
CONECT    8    9   25   26
CONECT    9   10   10   11
CONECT   11   27
CONECT   12   13
CONECT   13   14   28   29
CONECT   14   15   15   16
CONECT   16   30
END
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SMILES for HMDB0000245 (Porphobilinogen)

NCC1=C(CC(O)=O)C(CCC(O)=O)=CN1
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INCHI for HMDB0000245 (Porphobilinogen)

InChI=1S/C10H14N2O4/c11-4-8-7(3-10(15)16)6(5-12-8)1-2-9(13)14/h5,12H,1-4,11H2,(H,13,14)(H,15,16)
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Synonyms
ValueSource
5-(Aminomethyl)-4-(carboxymethyl)-pyrrole-3-propionateHMDB
5-(Aminomethyl)-4-(carboxymethyl)-pyrrole-3-propionic acidHMDB
PBGHMDB
PorphobilinogenHMDB
Chemical FormulaC10H14N2O4
Average Molecular Weight226.2292
Monoisotopic Molecular Weight226.095356946
IUPAC Name3-[5-(aminomethyl)-4-(carboxymethyl)-1H-pyrrol-3-yl]propanoic acid
Traditional Nameporphobilinogen
CAS Registry Number487-90-1
SMILES
NCC1=C(CC(O)=O)C(CCC(O)=O)=CN1
InChI Identifier
InChI=1S/C10H14N2O4/c11-4-8-7(3-10(15)16)6(5-12-8)1-2-9(13)14/h5,12H,1-4,11H2,(H,13,14)(H,15,16)
InChI KeyQSHWIQZFGQKFMA-UHFFFAOYSA-N
Chemical Taxonomy
Description Belongs to the class of organic compounds known as aralkylamines. These are alkylamines in which the alkyl group is substituted at one carbon atom by an aromatic hydrocarbyl group.
KingdomOrganic compounds
Super ClassOrganic nitrogen compounds
ClassOrganonitrogen compounds
Sub ClassAmines
Direct ParentAralkylamines
Alternative Parents
Substituents
  • Aralkylamine
  • Dicarboxylic acid or derivatives
  • Substituted pyrrole
  • Heteroaromatic compound
  • Pyrrole
  • Amino acid
  • Amino acid or derivatives
  • Carboxylic acid derivative
  • Azacycle
  • Carboxylic acid
  • Organoheterocyclic compound
  • Organopnictogen compound
  • Primary amine
  • Organooxygen compound
  • Primary aliphatic amine
  • Organic oxygen compound
  • Hydrocarbon derivative
  • Carbonyl group
  • Organic oxide
  • Aromatic heteromonocyclic compound
Molecular FrameworkAromatic heteromonocyclic compounds
External Descriptors
Ontology
Physiological effect
Health effect
Disposition
Biological locationRoute of exposureSource