CHEBI:188446 - (2-oxoindol-3-yl)acetyl-CoA(4−)

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name (2-oxoindol-3-yl)acetyl-CoA(4−)
ChEBI ID CHEBI:188446
ChEBI ASCII Name (2-oxoindol-3-yl)acetyl-CoA(4-)
Stars This entity has been manually annotated by a third party.
Submitter Kristian Axelsen
Supplier Information
Download Molfile XML SDF
Formula C31H39N8O18P3S
Net Charge -4
Average Mass 936.670
Monoisotopic Mass 936.13378
InChI InChI=1S/C31H43N8O18P3S/c1-31(2,25(43)29(45)34-8-7-20(40)33-9-10-61-21(41)11-17-16-5-3-4-6-18(16)38-28(17)44)13-54-60(51,52)57-59(49,50)53-12-19-24(56-58(46,47)48)23(42)30(55-19)39-15-37-22-26(32)35-14-36-27(22)39/h3-6,14-15,17,19,23-25,30,42-43H,7-13H2,1-2H3,(H,33,40)(H,34,45)(H,38,44)(H,49,50)(H,51,52)(H2,32,35,36)(H2,46,47,48)/p-4/t17?,19-,23-,24-,25+,30-/m1/s1
InChIKey FNICQZVXFBLDDL-KAXUAMJNSA-J
SMILES [C@@H]1(N2C3=C(C(=NC=N3)N)N=C2)O[C@H](COP(OP(OCC(C)([C@H](C(NCCC(NCCSC(=O)CC4C(NC=5C=CC=CC54)=O)=O)=O)O)C)(=O)[O-])(=O)[O-])[C@H]([C@H]1O)OP([O-])([O-])=O
ChEBI Ontology
Outgoing (2-oxoindol-3-yl)acetyl-CoA(4−) (CHEBI:188446) is a acyl-CoA(4−) (CHEBI:58342)
Synonym Source
(2-oxoindol-3-yl)acetyl-CoA UniProt
Citation Waiting for Citations Type Source
34059946 PubMed citation SUBMITTER