CHEBI:81547 - Bacteriochlorophyllide b

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ChEBI Name Bacteriochlorophyllide b
ChEBI ID CHEBI:81547
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C35H34MgN4O6
Net Charge 0
Average Mass 630.97270
Monoisotopic Mass 630.23288
InChI InChI=1S/C35H36N4O6.Mg/c1-8-19-14(2)21-13-26-28(18(6)40)16(4)23(37-26)11-22-15(3)20(9-10-27(41)42)32(38-22)30-31(35(44)45-7)34(43)29-17(5)24(39-33(29)30)12-25(19)36-21;/h8,11-15,20,31H,9-10H2,1-7H3,(H3,36,37,38,39,40,41,42,43);/q;+2/p-2/b19-8-;/t14?,15-,20-,31+;/m0./s1
InChIKey PHSJREAVLQHRMS-QKPRITNQSA-L
SMILES COC(=O)[C@H]1C(=O)c2c(C)c3=CC4=N\C(=C/c5c(C(C)=O)c(C)c6\C=C7/N=C([C@@H](CCC(O)=O)[C@@H]7C)C1=c2n3[Mg]n56)C(C)C/4=C/C
ChEBI Ontology
Outgoing Bacteriochlorophyllide b (CHEBI:81547) is a metallotetrapyrrole (CHEBI:33909)
Manual Xref Database
C18156 KEGG COMPOUND
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