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Details

Stereochemistry ACHIRAL
Molecular Formula C34H32N4O6.Fe
Molecular Weight 648.486
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of HEME L

SMILES

[Fe++].Cc1c(CCC(O)=O)c2cc3[n-]c(cc4nc(cc5[n-]c(cc1n2)c(CO)c5C=C)c(C)c4C=C)c(CO)c3CCC(O)=O

InChI

InChIKey=SOGROULNSWAKGC-IUYFZOIUSA-L
InChI=1S/C34H34N4O6.Fe/c1-5-19-17(3)25-11-28-20(6-2)23(15-39)31(37-28)12-26-18(4)21(7-9-33(41)42)29(36-26)14-30-22(8-10-34(43)44)24(16-40)32(38-30)13-27(19)35-25;/h5-6,11-14,39-40H,1-2,7-10,15-16H2,3-4H3,(H4,35,36,37,38,41,42,43,44);/q;+2/p-2/b25-11-,26-12-,27-13-,28-11-,29-14-,30-14-,31-12-,32-13-;

HIDE SMILES / InChI

Molecular Formula Fe
Molecular Weight 55.845
Charge 2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Molecular Formula C34H30N4O6
Molecular Weight 590.6252
Charge -2
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 19:56:53 GMT 2025
Edited
by admin
on Mon Mar 31 19:56:53 GMT 2025
Record UNII
89KZP8XN3K
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
HEME L
Preferred Name English
Code System Code Type Description
FDA UNII
89KZP8XN3K
Created by admin on Mon Mar 31 19:56:53 GMT 2025 , Edited by admin on Mon Mar 31 19:56:53 GMT 2025
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Related Record Type Details
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