Chemical Compound

Rifamycin S analog

CAS Registry Number 172097-95-9
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Rifamycin S analog chemical structure
Primary Record

Rifamycin S analog

In stock
6,248 g
Purity
98.2 %
CAS
172097-95-9

Compound Identifiers & Properties

CAS
172097-95-9
PubChem CID
10349971
SMILES
C[C@@H]1[C@@H](OS(=O)O[C@H]1[C@@H](C)[C@@H]([C@H](C)/C=C/C=O)OC(=O)C)[C@@H](C)/C=C/C=C(/C)\C(=O)NC2=CC(=O)C3=C(C2=O)C(=C(C4=C3C(=O)[C@@](O4)(C)O)C)O
Canonical SMILES
CC(=O)O[C@@H]([C@H](C)[C@@H]1OS(=O)O[C@@H]([C@@H](C)/C=C/C=C(/C)C(=O)NC2=CC(=O)c3c(c(O)c(C)c4c3C(=O)[C@@](C)(O)O4)C2=O)[C@H]1C)[C@H](C)/C=C/C=O

Names & Synonyms

  • Rifamycin S analog
  • CID10349971
  • CID 10349971
  • 172097-95-9
  • Rifamycin, 12,29-deepoxy-27,28-didehydro-27-demethoxy-1,4-dideoxy-1,4,28,29-tetrahydro-12-hydroxy-1,4,29-trioxo-, cyclic 21,23-sulfite, (21(S),27E)-
  • [(E,1R,2R)-1-[(1S)-1-[(4S,5R,6S)-6-[(1S,2E,4Z)-6-[[(2S)-2,5-dihydroxy-2,4-dimethyl-1,6,9-trioxo-benzo[e]benzofuran-7-yl]amino]-1,5-dimethyl-6-oxo-hexa-2,4-dienyl]-5-methyl-2-oxo-1,3,2-dioxathian-4-yl]ethyl]-2-methyl-5-oxo-pent-3-enyl] acetate
  • Rifamycin,12,29-deepoxy-27,28-didehydro-27-demethoxy-1,4-dideoxy-1,4,28,29-tetrahydro-12-hydroxy-1,4,29-trioxo-, cyclic 21,23-sulfite, [21(S),27E]-