Pheophorbide b

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C35H34N4O6
Molecular Weight	606.6677
Optical Activity	UNSPECIFIED
Defined Stereocenters	3 / 3
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

CCC1=C(C=O)C2=NC1=CC3=C(C)C4=C(N3)C([C@@H](C(=O)OC)C4=O)=C5N=C(C=C6NC(=C2)C(C=C)=C6C)[C@@H](C)[C@@H]5CCC(O)=O

InChI

InChIKey=PROPHBCDMQAJMH-HSJXTSEBSA-N

InChI=1S/C35H34N4O6/c1-7-18-15(3)22-11-23-16(4)20(9-10-28(41)42)32(38-23)30-31(35(44)45-6)34(43)29-17(5)24(39-33(29)30)12-26-19(8-2)21(14-40)27(37-26)13-25(18)36-22/h7,11-14,16,20,31,36,39H,1,8-10H2,2-6H3,(H,41,42)/b22-11-,23-11-,24-12-,25-13-,26-12-,27-13-,32-30-/t16-,20-,31+/m0/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

Pheophorbide b

Common Name

English

NSC-75782

Preferred Name

English

9-Ethenyl-14-ethyl-13-formyl-21-(methoxycarbonyl)-4,8,18-trimethyl-20-oxo-3-phorbinepropanoic acid, (3S,4S,21R)-

Systematic Name

English

(3S,4S,21R)-9-Ethenyl-14-ethyl-13-formyl-21-(methoxycarbonyl)-4,8,18-trimethyl-20-oxo-3-phorbinepropanoic acid

Systematic Name

English

3-Phorbinepropanoic acid, 9-ethenyl-14-ethyl-13-formyl-21-(methoxycarbonyl)-4,8,18-trimethyl-20-oxo-, (3S,4S,21R)-

Systematic Name

English

Phaeophorbide b

Common Name

English

Code System Code Type Description

CAS

20239-99-0