Chemical Compound

3-Hydroxy-5-methylhex-4-enoyl-CoA

CAS Registry Number 1245945-90-7
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3-Hydroxy-5-methylhex-4-enoyl-CoA chemical structure
Primary Record

3-Hydroxy-5-methylhex-4-enoyl-CoA

In stock
5,369 g
Purity
99.4 %
CAS
1245945-90-7

Compound Identifiers & Properties

CAS
1245945-90-7
PubChem CID
9549330
SMILES
CC(=CC(CC(=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)O)C
Canonical SMILES
CC(C)=CC(O)CC(=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

  • 3-Hydroxy-5-methylhex-4-enoyl-CoA
  • orb3022233
  • SCHEMBL2937124
  • c1138
  • CID9549330
  • C16469
  • 3-Hydroxy-5-methylhex-4-enoyl-CoA; (Acyl-CoA); [M+H]+;
  • 1245945-90-7