CHEBI:34884 - Naphthyl-2-methyl-succinyl-CoA

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ChEBI Name Naphthyl-2-methyl-succinyl-CoA
ChEBI ID CHEBI:34884
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C36H48N7O19P3S
Net Charge 0
Average Mass 1007.791
Monoisotopic Mass 1007.19385
InChI InChI=1S/C36H48N7O19P3S/c1-36(2,30(48)33(49)39-10-9-25(44)38-11-12-66-35(50)23(15-26(45)46)14-20-7-8-21-5-3-4-6-22(21)13-20)17-59-65(56,57)62-64(54,55)58-16-24-29(61-63(51,52)53)28(47)34(60-24)43-19-42-27-31(37)40-18-41-32(27)43/h3-8,13,18-19,23-24,28-30,34,47-48H,9-12,14-17H2,1-2H3,(H,38,44)(H,39,49)(H,45,46)(H,54,55)(H,56,57)(H2,37,40,41)(H2,51,52,53)/t23?,24-,28-,29-,30?,34-/m1/s1
InChIKey BLFNYMNSRZKVBB-OUXQTKLWSA-N
SMILES CC(C)(COP(O)(=O)OP(O)(=O)OC[C@H]1O[C@H]([C@H](O)[C@@H]1OP(O)(O)=O)n1cnc2c(N)ncnc12)C(O)C(=O)NCCC(=O)NCCSC(=O)C(CC(O)=O)Cc1ccc2ccccc2c1
Metabolite of Species Details
Mus musculus (NCBI:txid10090) Source: BioModels - MODEL1507180067 See: PubMed
ChEBI Ontology
Outgoing Naphthyl-2-methyl-succinyl-CoA (CHEBI:34884) is a polyol (CHEBI:26191)
Synonym Source
Naphthyl-2-methyl-succinyl-CoA KEGG COMPOUND
Manual Xref Database
C14116 KEGG COMPOUND
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Registry Number Type Source
830357-87-4 CAS Registry Number KEGG COMPOUND
Last Modified
27 January 2016