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

ChEBI IDCHEBI:188446
ChEBI Name(2-oxoindol-3-yl)acetyl-CoA(4−)
Stars
ASCII Name(2-oxoindol-3-yl)acetyl-CoA(4-)
SubmitterKristian Axelsen
DownloadsMolfile
FormulaC31H39N8O18P3S
Net Charge-4
Average Mass936.680
Monoisotopic Mass936.13378
SMILESCC(C)(COP(=O)([O-])OP(=O)([O-])OC[C@H]1O[C@@H](n2cnc3c(N)ncnc32)[C@H](O)[C@@H]1OP(=O)([O-])[O-])[C@@H](O)C(=O)NCCC(=O)NCCSC(=O)CC1C(=O)Nc2ccccc21
InChIInChI=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
InChIKeyFNICQZVXFBLDDL-KAXUAMJNSA-J
ChEBI Ontology
Outgoing Relation(s)
(2-oxoindol-3-yl)acetyl-CoA(4−) (CHEBI:188446) is a acyl-CoA(4−) (CHEBI:58342)
UniProt Name  Source
(2-oxoindol-3-yl)acetyl-CoAUniProt
Citations