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uroporphyrin III

MNXM6473 is deprecated and here replaced by MNXM739177
!!! Alternative mappings exist !!!

Properties

Image

Occurences in reactions

MNX_ID

MNXM739177

	#reac
in my sandbox	0
in MNXref (generic)	2
in models (compartimentalized)	1

formula

C₄₀H₃₈N₄O₁₆

charge

mass

830.22828

reference

chebi:15436

InChIKey

VZVFNUAIRVUCEW-UJJXFSCMSA-N

InChI

InChI=1S/C40H38N4O16/c45-33(46)5-1-17-21(9-37(53)54)29-14-27-19(3-7-35(49)50)22(10-38(55)56)30(43-27)15-28-20(4-8-36(51)52)24(12-40(59)60)32(44-28)16-31-23(11-39(57)58)18(2-6-34(47)48)26(42-31)13-25(17)41-29/h13-16,41,44H,1-12H2,(H,45,46)(H,47,48)(H,49,50)(H,51,52)(H,53,54)(H,55,56)(H,57,58)(H,59,60)/b25-13-,26-13-,27-14-,28-15-,29-14-,30-15-,31-16-,32-16-

SMILES

O=C(O)CCC1=C(CC(=O)O)c2cc3[nH]c(cc4nc(cc5[nH]c(cc1n2)c(CC(=O)O)c5CCC(=O)O)C(CCC(=O)O)=C4CC(=O)O)c(CC(=O)O)c3CCC(=O)O

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:15436 chebi:15436	uroporphyrin III 3,8,13,17-tetrakis(carboxymethyl)porphyrin-2,7,12,18-tetrapropanoic acid 3,8,13,17-tetrakis(carboxymethyl)porphyrin-2,7,12,18-tetrapropionic acid Uroporphyrin III uroporphyrin 3
kegg.compound:C02469 keggC:C02469	Uroporphyrin III
hmdb:HMDB0000916	Uroporphyrin III 3,8,13,17-Tetrakis(carboxymethyl)porphyrin-2,7,12,18-tetrapropanoate 3,8,13,17-Tetrakis(carboxymethyl)porphyrin-2,7,12,18-tetrapropanoic acid 3,8,13,17-Tetrakis(carboxymethyl)porphyrin-2,7,12,18-tetrapropionate 3,8,13,17-Tetrakis(carboxymethyl)porphyrin-2,7,12,18-tetrapropionic acid 3,8,13,17-Tetramethyl-2,7,12,18-porphinetetrapropionate 3,8,13,17-Tetramethyl-2,7,12,18-porphinetetrapropionic acid 3-[9,14,20-tris(2-carboxyethyl)-5,10,15,19-tetrakis(carboxymethyl)-21,22,23,24-tetraazapentacyclo[16.2.1.1^{3,6}.1^{8,11}.1^{13,16}]tetracosa-1,3,5,7,9,11(23),12,14,16,18(21),19-undecaen-4-yl]propanoic acid Coproporphyrin III
metacyc.compound:UROPORPHYRIN_III metacycM:UROPORPHYRIN_III	uroporphyrin III 3,8,13,17-tetrakis(carboxymethyl)-21H,23H-prophine-2,7,12,18...
CHEBI:167479 chebi:167479	uroporphyrin III uroporphyrin III(8-)
hmdb:HMDB00916 chebi:15299 chebi:27255 chebi:9903 keggC:M_C02469	secondary/obsolete/fantasy identifier