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

ChEBI IDCHEBI:34884
ChEBI Namenaphthyl-2-methyl-succinyl-CoA
Stars
DefinitionAn acyl-CoA thioester that results from the formal condensation of the thiol group of coenzyme A with the 2-carboxy group of naphthyl-2-methyl-succinic acid.
Last Modified10 July 2025
DownloadsMolfile
FormulaC36H48N7O19P3S
Net Charge0
Average Mass1007.799
Monoisotopic Mass1007.19385
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)C(CC(=O)O)Cc1ccc2ccccc2c1
InChIInChI=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
InChIKeyBLFNYMNSRZKVBB-JIFARLPCSA-N
Species of MetaboliteComponentSourceComments
Mus musculus (ncbitaxon:10090) - PubMed (19425150) Source: BioModels - MODEL1507180067
Roles Classification
Chemical Roles:
acyl donor  Any donor that can transfer acyl groups between molecular entities.
Bronsted acid  A molecular entity capable of donating a hydron to an acceptor (Brønsted base).
ChEBI Ontology
Outgoing Relation(s)
naphthyl-2-methyl-succinyl-CoA (CHEBI:34884) has functional parent Naphthyl-2-methyl-succinic acid (CHEBI:34883)
naphthyl-2-methyl-succinyl-CoA (CHEBI:34884) is a acyl-CoA (CHEBI:17984)
naphthyl-2-methyl-succinyl-CoA (CHEBI:34884) is a monocarboxylic acid (CHEBI:25384)
naphthyl-2-methyl-succinyl-CoA (CHEBI:34884) is a naphthalenes (CHEBI:25477)
IUPAC Name 
(9R)-1-[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl]-3,5,9-trihydroxy-8,8-dimethyl-20-(naphthalen-2-ylmethyl)-10,14,19-trioxo-2,4,6-trioxa-18-thia-11,15-diaza-3,5-diphosphadocosan-22-oic acid 3,5-dioxide
Synonyms  Source
naphthyl-2-methyl-succinyl-CoAKEGG COMPOUND
2-(2-naphthylmethyl)succinyl-CoAChEBI
S-[4-hydrogen 2-(2-naphthalenylmethyl)butanedioate]coenzyme AChEBI
S-[4-hydrogen (2-naphthalenylmethyl)butanedioate]coenzyme AChEBI
naphthyl-2-methyl-succinyl-coenzyme AChEBI
Manual XrefsDatabases
C14116KEGG COMPOUND
Registry NumbersSources
CAS:830357-87-4KEGG COMPOUND
Citations