Chemical Compound

25-O-Deacetyl Rifabutin

CAS Registry Number 100324-63-8
25-O-Deacetyl Rifabutin chemical structure
Primary Record

25-O-Deacetyl Rifabutin

In stock
8,430 g
Purity
98.6 %
CAS
100324-63-8

Compound Identifiers & Properties

CAS
100324-63-8
PubChem CID
155908788
SMILES
C[C@H]1C=CC=C(C(=O)NC2=C(C3=C(C4=C(C(=C3O)C)O[C@@](C4=O)(OC=C[C@@H]([C@H]([C@H]([C@@H]([C@@H]([C@@H]([C@H]1O)C)O)C)O)C)OC)C)C5=NC6(CCN(CC6)C(C)(C)C)N=C25)O)C
Canonical SMILES
CO[C@H]1C=CO[C@@]2(C)Oc3c(C)c(O)c4c(O)c(c5c(c4c3C2=O)=NC2(CCN(C(C)(C)C)CC2)N=5)NC(=O)C(C)=CC=C[C@H](C)[C@H](O)[C@@H](C)[C@@H](O)[C@@H](C)[C@H](O)[C@@H]1C

Names & Synonyms

  • 25-O-Deacetyl Rifabutin
  • (7S,11S,12S,13S,14R,15R,16R,17S,18S)-1'-tert-butyl-2,13,15,17,32-pentahydroxy-11-methoxy-3,7,12,14,16,18,22-heptamethylspiro[8,33-dioxa-24,27,29-triazapentacyclo[23.6.1.14,7.05,31.026,30]tritriaconta-1(32),2,4,9,19,21,24,26,30-nonaene-28,4'-piperidine]-6,23-dione
  • 100324-63-8