CHEBI:74406 - 3-vinylbacteriochlorophyllide a(1−)

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ChEBI Name 3-vinylbacteriochlorophyllide a(1−) ChEBI ID CHEBI:74406 ChEBI ASCII Name 3-vinylbacteriochlorophyllide a(1-) Definition A cyclic tetrapyrrole anion that is the conjugate base of 3-vinylbacteriochlorophyllide a, obtained by deprotonation of the carboxy group. Stars This entity has been manually annotated by the ChEBI Team. Submitter KAX Supplier Information Download Molfile XML SDF Find compounds which contain this structure Find compounds which resemble this structure Take structure to the Advanced Search Formula C35H35MgN4O5 Net Charge -1 Average Mass 615.98120 Monoisotopic Mass 615.24634 InChI InChI=1S/C35H38N4O5.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;/h8,12-14,16-17,20-21,31H,1,9-11H2,2-7H3,(H3,36,37,38,39,40,41,42);/q;+2/p-3/t16-,17+,20-,21+,31-;/m1./s1 InChIKey AVEDVDGOEJPOAB-IBHSAMIZSA-K SMILES CC[C@@H]1[C@@H](C)C2=Cc3c(C=C)c(C)c4C=C5[C@@H](C)[C@H](CCC([O-])=O)C6=[N+]5[Mg--]5(n34)n3c(=CC1=[N+]25)c(C)c1C(=O)[C@H](C(=O)OC)C6=c31 ChEBI Ontology Outgoing 3-vinylbacteriochlorophyllide a(1−) (CHEBI:74406) is a cyclic tetrapyrrole anion (CHEBI:58941) 3-vinylbacteriochlorophyllide a(1−) (CHEBI:74406) is a monocarboxylic acid anion (CHEBI:35757) 3-vinylbacteriochlorophyllide a(1−) (CHEBI:74406) is conjugate acid of 3-vinylbacteriochlorophyllide a(2−) (CHEBI:83373) 3-vinylbacteriochlorophyllide a(1−) (CHEBI:74406) is conjugate base of 3-vinylbacteriochlorophyllide a (CHEBI:74628) Incoming 3-vinylbacteriochlorophyllide a (CHEBI:74628) is conjugate acid of 3-vinylbacteriochlorophyllide a(1−) (CHEBI:74406) 3-vinylbacteriochlorophyllide a(2−) (CHEBI:83373) is conjugate base of 3-vinylbacteriochlorophyllide a(1−) (CHEBI:74406) IUPAC Name {3-[(3S,4S,13R,14R,21R)-14-ethyl-21-(methoxycarbonyl)-4,8,13,18-tetramethyl-20-oxo-9-vinyl-13,14-dihydrophorbin-3-yl-κ4N23,N24,N25,N26]propanoato(3−)}magnesate(1−) Manual Xref Database CPD-9097 MetaCyc View more database links Citation Type Source 16571720 PubMed citation SUBMITTER Last Modified 08 February 2016