Chemical Compound

2-Methylacetoacetyl Coa

CAS Registry Number 6701-38-8
Back to search Request a Quote
2-Methylacetoacetyl Coa chemical structure
Primary Record

2-Methylacetoacetyl Coa

In stock
6,649 g
Purity
99.6 %
CAS
6701-38-8

Compound Identifiers & Properties

CAS
6701-38-8
PubChem CID
56851693
SMILES
CC(C(C)O)C(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]1[C@H]([C@H]([C@@H](O1)N2C=NC3=C(N=CN=C32)N)O)OP(=O)(O)O)O
Canonical SMILES
CC(O)C(C)C(=O)SCCNC(=O)CCNC(=O)[C@H](O)C(C)(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

Names & Synonyms

  • 2-Methylacetoacetyl Coa
  • 3-hydroxy-2-methylbutyryl-CoA
  • SCHEMBL639538
  • orb3022194
  • SCHEMBL29531040
  • DTXSID101261676
  • Coenzyme A, S-(3-hydroxy-2-methylbutanoate)
  • 6701-38-8
  • S-(3-Hydroxy-2-methylbutyrate) Coenzyme A
  • MC4
  • S-(2-(3-((2R)-4-(((((((2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)tetrahydrofuran-2-yl)methoxy)(hydroxy)phosphoryl)oxy)(hydroxy)phosphoryl)oxy)-2-hydroxy-3,3-dimethylbutanamido)propanamido)ethyl) 3-hydroxy-2-methylbutanethioate
  • S-{(9R)-1-[(2R,3S,4R,5R)-5-(6-Amino-9H-purin-9-yl)-4-hydroxy-3-(phosphonooxy)oxolan-2-yl]-3,5,9-trihydroxy-8,8-dimethyl-3,5,10,14-tetraoxo-2,4,6-trioxa-11,15-diaza-3lambda~5~,5lambda~5~-diphosphaheptadecan-17-yl} 3-hydroxy-2-methylbutanethioate