AC1L7G4H
(3R,5aS,6S,9aR,10aS)-5a,10a-dimethyl-9-methylidene-3-propan-2-yl-2,5,6,7,8,10-hexahydro-1H-benzo[f]azulene-3,6,9a-triol
Also Known As: DOLASTA-1 (15), 4,9,14-TRIHYDROXY B704730|(3R,5aS,6S,9aR,10aS)-5a,10a-dimethyl-9-methylidene-3-propan-2-yl-2,5,6,7,8,10-hexahydro-1H-benzo[f]azulene-3,6,9a-triol|(1R,3aS,4aR,8S,8aS)-3a,8a-Dimethyl-5-methylidene-1-(propan-2-yl)-2,3,3a,4,5,6,7,8,8a,9-decahydrobenzo[f]azulene-1,4a,8(1H)-triol
| Molecular Formula | C20H32O3 |
|---|---|
| Molecular Weight | 320.23514 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 60.7 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 320.23514 |
| Monoisotopic Mass | 320.23514 |
| Heavy Atoms | 23 |
| Complexity | 565.0 |
Chemical Identifiers
| CAS Number | 80243-68-1 |
|---|---|
| SMILES | CC(C)[C@@]1(CC[C@@]2(C1=CC[C@]3([C@H](CCC(=C)[C@@]3(C2)O)O)C)C)O |
| InChIKey | BHLWYXNPQWHDHX-WKWVNEEDSA-N |
Product Overview
AC1L7G4H (CAS 80243-68-1), with molecular formula C20H32O3 and molecular weight 320.23514 g/mol. IUPAC: (3R,5aS,6S,9aR,10aS)-5a,10a-dimethyl-9-methylidene-3-propan-2-yl-2,5,6,7,8,10-hexahydro-1H-benzo[f]azulene-3,6,9a-triol.
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