HDE

CIS-HEME D HYDROXYCHLORIN GAMMA-SPIROLACTONE 17R, 18S



Chemical Component Summary

NameCIS-HEME D HYDROXYCHLORIN GAMMA-SPIROLACTONE 17R, 18S
Identifiersn/a
FormulaC34 H38 Fe N4 O5
Molecular Weight638.534
TypeNON-POLYMER
Isomeric SMILESCCc1c(c2n3c1Cc4c(c(c5n4[Fe]36n7c(c(c(c7C=C8N6C(=C5)[C@@]9([C@@]8(C)O)CCC(=O)O9)C)CC)C2)CCC(=O)O)C)C
InChIInChI=1S/C34H38N4O5.Fe/c1-7-20-17(3)23-13-27-21(8-2)18(4)25(37-27)15-29-33(6,42)34(12-11-32(41)43-34)30(38-29)16-28-22(9-10-31(39)40)19(5)24(36-28)14-26(20)35-23;/h15-16,42H,7-14H2,1-6H3,(H,39,40);/q-4;+4/b29-15-,30-16-;/t33-,34+;/m0./s1
InChIKeySQSYUADQFVTXKU-CAMYIWQSSA-N

Chemical Details

Formal Charge0
Atom Count82
Chiral Atom Count4
Bond Count90
Aromatic Bond Count15

Related Resource References

Resource NameReference
PubChem 49867090