CHLOROPHYLL C3

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C36H28N4O7.Mg
Molecular Weight	652.9351
Optical Activity	UNSPECIFIED
Defined Stereocenters	1 / 1
E/Z Centers	1
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

[Mg++].COC(=O)[C@H]1C(=O)c2c(C)c3cc4nc(cc5[n-]c(cc6nc(c(\C=C\C(O)=O)c6C)c1c2[n-]3)c(C)c5C=C)c(C(=O)OC)c4C=C

InChI

InChIKey=AXLMYDJSVAACBE-VKDSHVEMSA-L

InChI=1S/C36H30N4O7.Mg/c1-8-18-15(3)21-12-22-16(4)20(10-11-27(41)42)32(39-22)30-31(36(45)47-7)34(43)28-17(5)23(40-33(28)30)13-25-19(9-2)29(35(44)46-6)26(38-25)14-24(18)37-21;/h8-14,31H,1-2H2,3-7H3,(H3,37,38,39,40,41,42,43,44);/q;+2/p-2/b11-10+,21-12-,22-12-,23-13-,24-14-,25-13-,26-14-,32-30-;/t31-;/m1./s1

HIDE SMILES / InChI

Molecular Formula	C36H27N4O7
Molecular Weight	627.6222
Charge	-1
Count

Stereochemistry	ABSOLUTE
Additional Stereochemistry	No
Defined Stereocenters	1 / 1
E/Z Centers	1
Optical Activity	UNSPECIFIED

Molecular Formula	Mg
Molecular Weight	24.305
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 21:10:53 GMT 2025` Edited by `admin` on `Mon Mar 31 21:10:53 GMT 2025`
Record UNII	FMN10170B8
Record Status	`Validated (UNII)`
Record Version

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Name

Type

Language

CHLOROPHYLL C3

Common Name

English

MAGNESATE(1-), (13,21-DIMETHYL (21R)-3-((1E)-2-CARBOXYETHENYL)-3,4-DIDEHYDRO-9,14-DIETHENYL-4,8,18-TRIMETHYL-20-OXO-13,21-PHORBINEDICARBOXYLATO(3-)-.KAPPA.N23,.KAPPA.N24,.KAPPA.N25,.KAPPA.N26)-, HYDROGEN (1:1), (SP-4-2)-

Preferred Name

English

MAGNESATE(1-), (13,21-DIMETHYL 3-(2-CARBOXYETHENYL)-3,4-DIDEHYDRO-9,14-DIETHENYL-4,8,18-TRIMETHYL-20-OXO-13,21-PHORBINEDICARBOXYLATO(3-)-N23,N24,N25,N26)-, HYDROGEN, (SP-4-2-(E))-

Common Name

English

MAGNESATE(1-), (13,21-DIMETHYL 3-(2-CARBOXYETHENYL)-3,4-DIDEHYDRO-9,14-DIETHENYL-4,8,18-TRIMETHYL-20-OXO-13,21-PHORBINEDICARBOXYLATO(3-)-.KAPPA.N23,.KAPPA.N24,.KAPPA.N25,.KAPPA.N26)-, HYDROGEN, (SP-4-2-(E))-

Common Name

English

Code System Code Type Description

CAS

111308-93-1

Created by admin on Mon Mar 31 21:10:53 GMT 2025 , Edited by admin on Mon Mar 31 21:10:53 GMT 2025

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FDA UNII

FMN10170B8

Created by admin on Mon Mar 31 21:10:53 GMT 2025 , Edited by admin on Mon Mar 31 21:10:53 GMT 2025

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PUBCHEM

71587417

Created by admin on Mon Mar 31 21:10:53 GMT 2025 , Edited by admin on Mon Mar 31 21:10:53 GMT 2025

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