CHEBI:57855 - protochlorophyllide(1−)

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ChEBI Name protochlorophyllide(1−)
ChEBI ID CHEBI:57855
ChEBI ASCII Name protochlorophyllide(1-)
Definition A cyclic tetrapyrrole anion that is the conjugate base of protochlorophyllide, arising from deprotonation of the carboxy group.
Stars This entity has been manually annotated by the ChEBI Team.
Supplier Information ChemicalBook:CB4440420, eMolecules:505008, ZINC000000895466
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Formula C35H31MgN4O5
Net Charge -1
Average Mass 611.95000
Monoisotopic Mass 611.21504
InChI InChI=1S/C35H34N4O5.Mg/c1-8-19-15(3)22-12-24-17(5)21(10-11-28(40)41)32(38-24)30-31(35(43)44-7)34(42)29-18(6)25(39-33(29)30)14-27-20(9-2)16(4)23(37-27)13-26(19)36-22;/h8,12-14,31H,1,9-11H2,2-7H3,(H3,36,37,38,39,40,41,42);/q;+2/p-3/b22-12-,23-13-,24-12-,25-14-,26-13-,27-14-,32-30-;/t31-;/m1./s1
InChIKey QBPCOMNNISRCTC-KKNVGXODSA-K
SMILES CCC1=C(C)C2=[N+]3C1=Cc1c(C)c4C(=O)[C@H](C(=O)OC)C5=C6C(CCC([O-])=O)=C(C)C7=[N+]6[Mg--]3(n1c45)n1c(=C7)c(C)c(C=C)c1=C2
ChEBI Ontology
Outgoing protochlorophyllide(1−) (CHEBI:57855) is a cyclic tetrapyrrole anion (CHEBI:58941)
protochlorophyllide(1−) (CHEBI:57855) is a monocarboxylic acid anion (CHEBI:35757)
protochlorophyllide(1−) (CHEBI:57855) is conjugate acid of protochlorophyllide(2−) (CHEBI:83350)
protochlorophyllide(1−) (CHEBI:57855) is conjugate base of protochlorophyllide (CHEBI:16673)
Incoming protochlorophyllide (CHEBI:16673) is conjugate acid of protochlorophyllide(1−) (CHEBI:57855)
protochlorophyllide(2−) (CHEBI:83350) is conjugate base of protochlorophyllide(1−) (CHEBI:57855)
IUPAC Name
{3-[(21R)-9-ethenyl-14-ethyl-21-(methoxycarbonyl)-4,8,13,18-tetramethyl-20-oxo-3,4-didehydrophorbin-3-yl-κ2N23,N25]propanoato(3−)}magnesate(1−)
Synonym Source
protochlorophyllide anion ChEBI
Last Modified
05 January 2015