U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C55H70N4O6.Mg
Molecular Weight 907.4725
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 5
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of CHLOROPHYLL B

SMILES

[Mg++].CCC1=C(C=O)C2=NC1=CC3=C(C)C4=C([N-]3)C([C@@H](C(=O)OC)C4=O)=C5N=C(C=C6[N-]C(=C2)C(C=C)=C6C)[C@@H](C)[C@@H]5CCC(=O)OC\C=C(/C)CCC[C@H](C)CCC[C@H](C)CCCC(C)C

InChI

InChIKey=NSMUHPMZFPKNMZ-VBYMZDBQSA-M
InChI=1S/C55H71N4O6.Mg/c1-12-38-35(8)42-27-43-36(9)40(23-24-48(61)65-26-25-34(7)22-16-21-33(6)20-15-19-32(5)18-14-17-31(3)4)52(58-43)50-51(55(63)64-11)54(62)49-37(10)44(59-53(49)50)28-46-39(13-2)41(30-60)47(57-46)29-45(38)56-42;/h12,25,27-33,36,40,51H,1,13-24,26H2,2-11H3,(H-,56,57,58,59,60,62);/q-1;+2/p-1/b34-25+;/t32-,33-,36+,40+,51-;/m1./s1

HIDE SMILES / InChI

Approval Year

Name Type Language
CHLOROPHYLL B
MI  
Common Name English
CHLOROPHYLL-.BETA.
Common Name English
INS NO.140(PHAEOPHYTIN B)
Common Name English
.BETA.-CHLOROPHYLL
Common Name English
MAGNESIUM, ((2E,7R,11R)-3,7,11,15-TETRAMETHYL-2-HEXADECENYL (3S,4S,21R)-9-ETHENYL-14-ETHYL-13-FORMYL-21-(METHOXYCARBONYL)-4,8,18-TRIMETHYL-20-OXO-3-PHORBINEPROPANOATO(2-)-.KAPPA.N23,.KAPPA.N24,.KAPPA.N25,.KAPPA.N26)-, (SP-4-2)-
Common Name English
MAGNESIUM, (DIHYDROGEN 21-CARBOXY-14-ETHYL-13-FORMYL-4,8,18-TRIMETHYL-20-OXO-9-VINYL-3-PHORBINEPROPIONATO(2-))-, 21-METHYL 3-PHYTYL ESTER, (E)-
Common Name English
PHAEOPHYTIN- B
Common Name English
INS-140(PHAEOPHYTIN B)
Common Name English
3-PHORBINEPROPANOIC ACID, 9-ETHENYL-14-ETHYL-13-FORMYL-21-(METHOXYCARBONYL)-4,8,18-TRIMETHYL-20-OXO-, 3,7,11,15-TETRAMETHYL-2-HEXADECENYL ESTER, MAGNESIUM COMPLEX, (3S-(3.ALPHA.(2E,7S*,11S*),4.BETA.,21.BETA.))-
Common Name English
MAGNESIUM, (3,7,11,15-TETRAMETHYL-2-HEXADECENYL 9-ETHENYL-14-ETHYL-13-FORMYL-21-(METHOXYCARBONYL)-4,8,18-TRIMETHYL-20-OXO-3-PHORBINEPROPANOATO(2-)-.KAPPA.N23,.KAPPA.N24,.KAPPA.N25,.KAPPA.N26)-, (SP-4-2-(3S-(3.ALPHA.(2E,7S*,11S*),4.BETA.,21.BETA.)))-
Common Name English
CHLOROPHYLL B [MI]
Common Name English
MAGNESIUM, (3,7,11,15-TETRAMETHYL-2-HEXADECENYL 9-ETHENYL-14-ETHYL-13-FORMYL-21-(METHOXYCARBONYL)-4,8,18-TRIMETHYL-20-OXO-3-PHORBINEPROPANOATO(2-)-N23,N24,N25,N26)-, (SP-4-2-(3S-(3.ALPHA.(2E,7S*,11S*),4.BETA.,21.BETA.)))-
Common Name English
E-140(PHAEOPHYTIN B)
Common Name English
Classification Tree Code System Code
JECFA EVALUATION INS-140(PHAEOPHYTIN B)
Created by admin on Sat Dec 16 02:03:44 GMT 2023 , Edited by admin on Sat Dec 16 02:03:44 GMT 2023
CODEX ALIMENTARIUS (GSFA) INS-140(PHAEOPHYTIN B)
Created by admin on Sat Dec 16 02:03:44 GMT 2023 , Edited by admin on Sat Dec 16 02:03:44 GMT 2023
Code System Code Type Description
DRUG BANK
DB04506
Created by admin on Sat Dec 16 02:03:44 GMT 2023 , Edited by admin on Sat Dec 16 02:03:44 GMT 2023
PRIMARY
ECHA (EC/EINECS)
208-272-4
Created by admin on Sat Dec 16 02:03:44 GMT 2023 , Edited by admin on Sat Dec 16 02:03:44 GMT 2023
PRIMARY
MESH
C037184
Created by admin on Sat Dec 16 02:03:44 GMT 2023 , Edited by admin on Sat Dec 16 02:03:44 GMT 2023
PRIMARY
WIKIPEDIA
CHLOROPHYLL B
Created by admin on Sat Dec 16 02:03:44 GMT 2023 , Edited by admin on Sat Dec 16 02:03:44 GMT 2023
PRIMARY
CHEBI
27888
Created by admin on Sat Dec 16 02:03:44 GMT 2023 , Edited by admin on Sat Dec 16 02:03:44 GMT 2023
PRIMARY
EPA CompTox
DTXSID70889349
Created by admin on Sat Dec 16 02:03:44 GMT 2023 , Edited by admin on Sat Dec 16 02:03:44 GMT 2023
PRIMARY
CAS
519-62-0
Created by admin on Sat Dec 16 02:03:44 GMT 2023 , Edited by admin on Sat Dec 16 02:03:44 GMT 2023
PRIMARY
FDA UNII
5712ZB110R
Created by admin on Sat Dec 16 02:03:44 GMT 2023 , Edited by admin on Sat Dec 16 02:03:44 GMT 2023
PRIMARY
SMS_ID
100000143273
Created by admin on Sat Dec 16 02:03:44 GMT 2023 , Edited by admin on Sat Dec 16 02:03:44 GMT 2023
PRIMARY
MERCK INDEX
m3428
Created by admin on Sat Dec 16 02:03:44 GMT 2023 , Edited by admin on Sat Dec 16 02:03:44 GMT 2023
PRIMARY Merck Index
CHEBI
61721
Created by admin on Sat Dec 16 02:03:44 GMT 2023 , Edited by admin on Sat Dec 16 02:03:44 GMT 2023
PRIMARY
PUBCHEM
11593175
Created by admin on Sat Dec 16 02:03:44 GMT 2023 , Edited by admin on Sat Dec 16 02:03:44 GMT 2023
PRIMARY
EVMPD
SUB119821
Created by admin on Sat Dec 16 02:03:44 GMT 2023 , Edited by admin on Sat Dec 16 02:03:44 GMT 2023
PRIMARY