uroporphyrinogen-I

Chemical Formula:

C₄₀H₃₆N₄O₁₆

Molecular Weight:

828.742 Daltons

Monoisotopic Mass:

836.2752313868 Daltons

SMILES:

C(=O)([O-])CCC5(=C4(NC(CC1(NC(=C(CC([O-])=O)C(CCC(=O)[O-])=1)CC2(NC(=C(C(CCC(=O)[O-])=2)CC(=O)[O-])CC3(=C(CCC([O-])=O)C(CC(=O)[O-])=C(N3)C4))))=C(CC(=O)[O-])5))

InChI:

1S/C40H44N4O16/c45-33(46)5-1-17-21(9-37(53)54)29-14-26-19(3-7-35(49)50)23(11-39(57)58)31(43-26)16-28-20(4-8-36(51)52)24(12-40(59)60)32(44-28)15-27-18(2-6-34(47)48)22(10-38(55)56)30(42-27)13-25(17)41-29/h41-44H,1-16H2,(H,45,46)(H,47,48)(H,49,50)(H,51,52)(H,53,54)(H,55,56)(H,57,58)(H,59,60)/p-8

InChIKey:

QTTNOSKSLATGQB-UHFFFAOYSA-F

Synonyms

uroporphyrinogen I

Databases

MetaCyc: CPD-11444

ChEBI: 62626

PubChem (CID): 25201940

HMDB: HMDB02211

ChemSpider: 389644

KEGG: C05766

Reactome: 190157

Seed: cpd03414

MetaNetX: MNXM1123