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Substance Name: Chlorophyll C3
RN: 111308-93-1
UNII: FMN10170B8
InChIKey: AXLMYDJSVAACBE-VKDSHVEMSA-L

Molecular Weight

  • 652.9432
 
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Names and Synonyms

Name of Substance

  • Chlorophyll C3

Synonyms

  • 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-)kappa23,kappan24,kappan25,kappan26)-, hydrogen (1:1), (sp-4-2)-
  • Magnesate(1-), (13,21-dimethyl 3-(2-carboxyethenyl)-3,4-didehydro-9,14-diethenyl-4,8,18-trimethyl-20-oxo-13,21-phorbinedicarboxylato(3-)-kappan23,kappan24,kappan25,kappan26)-, hydrogen, (sp-4-2-(E))-
  • 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))-
  • UNII-FMN10170B8

Registry Numbers

CAS Registry Number

  • 111308-93-1

FDA UNII

  • FMN10170B8

System Generated Number

  • 0111308931

Structure Descriptors

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

InChIKey

AXLMYDJSVAACBE-VKDSHVEMSA-L

Smiles

Cc1/c/2c/c3n/c(c/4\c5c(c(c([n-]5)/cc/6\nc(/cc(/c1C=C)\[n-]2)C(=C6C=C)C(=O)OC)C)C(=O)[C@@H]4C(=O)OC)/C(=C3C)/C=C/C(=O)O.[Mg+2]