Chemical Compound

CHEBI:85909

CHEBI:85909 chemical structure
Primary Record

CHEBI:85909

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
90659334
SMILES
C[C@@H]([C@H]1CC[C@@H]2[C@@]1(CC[C@]3([C@H]2CCC4=CC(=O)CC[C@@]43C)O)C)C(=O)SCCNC(=O)CCNC(=O)[C@@H](C(C)(C)COP(=O)(O)OP(=O)(O)OC[C@@H]5[C@H]([C@H]([C@@H](O5)N6C=NC7=C(N=CN=C76)N)O)OP(=O)(O)O)O
Canonical SMILES
C[C@H](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)[C@H]1CC[C@H]2[C@@H]3CCC4=CC(=O)CC[C@]4(C)[C@@]3(O)CC[C@]12C

Names & Synonyms

  • CHEBI:85909
  • 9alpha-hydroxy-3-oxo-23,24-bisnorchol-4-en-22-oyl-CoA
  • Q27158787
  • 9alpha-hydroxy-3-oxo-23,24-bisnorchol-4-en-22-oyl-coenzyme A