7-DES(1-HYDROXYETHYL)-7-ETHENYL HEMATOPORPHYRIN

Details

Stereochemistry	RACEMIC
Molecular Formula	C34H34N4O5
Molecular Weight	578.6576
Optical Activity	( + / - )
Defined Stereocenters	0 / 1
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure of 7-DES(1-HYDROXYETHYL)-7-ETHENYL HEMATOPORPHYRIN

Structure Search

SMILES

CC(O)c1c(C)c2cc3nc(cc4nc(cc5nc(cc1n2)c(C)c5C=C)c(C)c4CCC(O)=O)c(CCC(O)=O)c3C

InChI

InChIKey=AMDBLDGICFZSOP-AWKNCVNESA-N

InChI=1S/C34H36N4O5/c1-7-21-16(2)26-14-31-34(20(6)39)19(5)27(38-31)12-24-17(3)22(8-10-32(40)41)29(36-24)15-30-23(9-11-33(42)43)18(4)25(37-30)13-28(21)35-26/h7,12-15,20,37-39H,1,8-11H2,2-6H3,(H,40,41)(H,42,43)/b24-12-,25-13-,26-14-,27-12-,28-13-,29-15-,30-15-,31-14-

HIDE SMILES / InChI

Molecular Formula	C34H34N4O5
Molecular Weight	578.6576
Charge	0
Count

Stereochemistry	RACEMIC
Additional Stereochemistry	No
Defined Stereocenters	0 / 1
E/Z Centers	0
Optical Activity	( + / - )

Approval Year

Substance Class	Chemical Created by `admin` on `Mon Mar 31 22:34:36 GMT 2025` Edited by `admin` on `Mon Mar 31 22:34:36 GMT 2025`
Record UNII	8H8GR50XSY
Record Status	`Validated (UNII)`
Record Version

Download

Name

Type

Language

7-DES(1-HYDROXYETHYL)-7-ETHENYL HEMATOPORPHYRIN

Common Name

English

DEUTEROPORPHYRIN IX 2,4 (4,2) HYDROXYETHYL VINYL

Preferred Name

English

21H,23H-PORPHINE-2,18-DIPROPANOIC ACID, 7-ETHENYL-12-(1-HYDROXYETHYL)-3,8,13,17-TETRAMETHYL-

Systematic Name

English

Code System Code Type Description

PUBCHEM

455607

Created by admin on Mon Mar 31 22:34:36 GMT 2025 , Edited by admin on Mon Mar 31 22:34:36 GMT 2025

PRIMARY

EPA CompTox

DTXSID20332411

Created by admin on Mon Mar 31 22:34:36 GMT 2025 , Edited by admin on Mon Mar 31 22:34:36 GMT 2025

PRIMARY

FDA UNII

8H8GR50XSY

Created by admin on Mon Mar 31 22:34:36 GMT 2025 , Edited by admin on Mon Mar 31 22:34:36 GMT 2025

PRIMARY

CAS

77222-65-2

Created by admin on Mon Mar 31 22:34:36 GMT 2025 , Edited by admin on Mon Mar 31 22:34:36 GMT 2025

PRIMARY