Uroporphyrin I,小分子代谢物

Uroporphyrin I

SMPDB_ID

SMP0000346

通道名称

Porphyria Variegata (PV)

通路

Disease

代谢物ID

PW_C000747

CAS号

607-14-7

公式

C40H38N4O16

HMDB_ID

HMDB0000936

KEGG_ID

C05767

ChEBI_ID

27484

DrugBank_ID

IUPAC

3-[9,14,19-tris(2-carboxyethyl)-5,10,15,20-tetrakis(carboxymethyl)-21,22,23,24-tetraazapentacyclo[16.2.1.1椴?閳?1閳?楣块箍.1楣块瞾,楣块垿绂瞭etracosa-1(21),2,4,6,8(23),9,11,13,15,17,19-undecaen-4-yl]propanoic acid

微笑

OC(=O)CCC1=C(CC(O)=O)/C2=C/C3=N/C(=C\C4=C(CCC(O)=O)C(CC(O)=O)=C(N4)/C=C4\N=C(\C=C\1/N\2)C(CC(O)=O)=C4CCC(O)=O)/C(CC(O)=O)=C3CCC(O)=O

InChI

InChI=1S/C40H38N4O16/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/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-,26-14-,27-15-,28-16-,29-14-,30-13-,31-16-,32-15-

InChI关键

DAFUFNRZWDWXJP-JRHDEHKPSA-N