Chemical Compound

Rohituka 5

Rohituka 5 chemical structure
Primary Record

Rohituka 5

In stock
550 g
Purity
98.1 %

Compound Identifiers & Properties

PubChem CID
102588511
SMILES
CC[C@@H](C)[C@H](C(=O)O[C@H]1[C@H]2[C@@H](C(=C)[C@@]3([C@@]1([C@@H](C[C@@H]3OC(=O)C)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@H](O)[C@H](C)CC)[C@@]2(C)[C@H](c3ccoc3)C[C@H](OC(C)=O)[C@]12O

Names & Synonyms

  • Rohituka 5
  • J2.431.378F
  • (1R,2R,4S,5S,7S,8R,9R,10R,12S,16S,21R)-5-(acetyloxy)-7-(furan-3-yl)-4-hydroxy-1,8,16-trimethyl-3-methylidene-14,19-dioxo-11,15,18-trioxapentacyclo[10.9.0.02,10.04,8.016,21]henicosan-9-yl (2R,3R)-2-hydroxy-3-methylpentanoate
  • (2R,3R)-2-Hydroxy-3-methylpentanoic acid (4aS,7aS,8aR,9R,9aR,10S,12S,12aS,13aR,13bR,13cR)-12-acetoxy-10-(3-furyl)hexadecahydro-12a-hydroxy-4a,9a,13b-trimethyl-13-methylene-2,6-dioxo-2H,6H-cyclopenta[f]pyrano[4 ,3 :6,7]oxepino[4,5-b]benzofuran-9-yl ester