Chemical Compound

Rohituka 3

CAS Registry Number 70266-36-3
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Rohituka 3 chemical structure
Primary Record

Rohituka 3

In stock
2,594 g
Purity
99.1 %
CAS
70266-36-3

Compound Identifiers & Properties

CAS
70266-36-3
PubChem CID
21600055
SMILES
CCC(C)C(C(=O)O[C@H]1[C@H]2[C@@H](C(=C)[C@@]3([C@@]1([C@@H](CC3=O)C4=COC=C4)C)O)[C@@]5([C@H]6CC(=O)OC[C@]6(OC(=O)C[C@@H]5O2)C)C)O
Canonical SMILES
C=C1[C@@H]2[C@@H](O[C@H]3CC(=O)O[C@]4(C)COC(=O)C[C@@H]4[C@]32C)[C@H](OC(=O)C(O)C(C)CC)[C@@]2(C)[C@H](c3ccoc3)CC(=O)[C@]12O

Names & Synonyms

  • Rohituka 3
  • J934.469A
  • (13alpha,17alpha)-14beta-Hydroxy-4abeta-(hydroxymethyl)-4a-methyl-12alpha-(2-hydroxy-3-methyl-1-oxopentyloxy)-3,15-dioxo-4-oxa-1alpha,11beta:21,23-diepoxy-A-homo-24-nor-6,7-seco-5alpha-chola-7,20,22-triene-6-carboxylic acid delta-lactone
  • (1R,2R,4S,7S,8R,9R,10R,12S,16S,21R)-7-(furan-3-yl)-4-hydroxy-1,8,16-trimethyl-3-methylidene-5,14,19-trioxo-11,15,18-trioxapentacyclo[10.9.0.02,10.04,8.016,21]henicosan-9-yl 2-hydroxy-3-methylpentanoate
  • 70266-36-3
  • Pentanoic acid, 2-hydroxy-3-methyl-, (4aS,7aS,8aR,9R,9aR,10S,12aS,13aR,13bR,13cR)-10-(3-furanyl)hexadecahydro-12a-hydroxy-4a,9a,13b-trimethyl-13-methylene-2,6,12-trioxo-2H,6H-cyclopenta(f)pyrano(4',3':6,7)oxepino(4,5-b)benzofuran-9-yl ester, (2R,3R)-