Chemical Compound

CHEMBL405054

CHEMBL405054 chemical structure
Primary Record

CHEMBL405054

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
6476843
SMILES
C[C@@H]1CCCC/C=C(/[C@H](C[C@@H]2CC[C@H]([C@@](O2)(C(=O)C(=O)N3CCCC[C@H]3C(=O)O[C@@H](CC(=O)[C@@H](/C=C(/[C@H]([C@H](C(=O)[C@@H](C1)C)OC)O)\C)C)[C@H](C)C[C@@H]4CC[C@H]([C@@H](C4)OC)OC(=O)C5=CC=C(C=C5)[N+](=O)[O-])O)C)OC)\C
Canonical SMILES
CO[C@H]1C[C@@H]2CC[C@@H](C)[C@@](O)(O2)C(=O)C(=O)N2CCCC[C@H]2C(=O)O[C@H]([C@H](C)C[C@@H]2CC[C@@H](OC(=O)c3ccc([N+](=O)[O-])cc3)[C@H](OC)C2)CC(=O)[C@H](C)/C=C(\C)[C@@H](O)[C@@H](OC)C(=O)[C@H](C)C[C@H](C)CCCC/C=C/1C

Names & Synonyms

  • CHEMBL405054
  • 1,2,3,4-Tetrahydrorapamycin deriv
  • (R)-OCO-pNO2Ph-1,2,3,4-tetrahydrorapamycin
  • [(1R,2R,4S)-4-[(2R)-2-(dihydroxy-dimethoxy-hexamethyl-pentaoxo-[?]yl)propyl]-2-methoxy-cyclohexyl] 4-nitrobenzoate