CID6442985
[(2S,8S,9S,10R,11R)-10-hydroxy-2,11-dimethyl-7-methylidene-6,12-dioxo-5,14-dioxatricyclo[9.2.1.04,8]tetradec-1(13)-en-9-yl] (E)-2-methylbut-2-enoate
Also Known As: 2-Butenoic acid, 2-methyl-, 2,3,3a,4,5,6,7,10,11,11a-decahydro-5-hydroxy- 6,10-dimethyl-3-methylene-2,7-dioxo-6,9-epoxycyclodeca(b)furan-4-yl ester, (3aS-(3aR*,4R*(Z),5S*,6S*,10S*,10aR*))|2-Butenoic acid, 2-methyl-, 2,3,3a,4,5,6,7,10,11,11a-decahydro-5-hydroxy-6,10-dimethyl-3-methylene-2,7-dioxo-6,9-epoxycyclodeca(b)furan-4-yl ester, (3aS-(3aR*,4R*(Z),5S*,6S*,10S*,10aR*))
| Molecular Formula | C20H24O7 |
|---|---|
| Molecular Weight | 376.1522 g/mol |
| LogP | 1.6048 |
| Topological Polar Surface Area | 99.13 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 2 |
| Exact Mass | 376.1522 |
| Monoisotopic Mass | 376.1522 |
| Heavy Atoms | 27 |
| Complexity | 777.1997 |
Chemical Identifiers
| CAS Number | 92008-84-9 |
|---|---|
| SMILES | C/C=C(\C)/C(=O)O[C@H]1[C@@H]2C(C[C@@H](C3=CC(=O)[C@@]([C@@H]1O)(O3)C)C)OC(=O)C2=C |
Product Overview
CID6442985 (CAS 92008-84-9), with molecular formula C20H24O7 and molecular weight 376.1522 g/mol. IUPAC: [(2S,8S,9S,10R,11R)-10-hydroxy-2,11-dimethyl-7-methylidene-6,12-dioxo-5,14-dioxatricyclo[9.2.1.04,8]tetradec-1(13)-en-9-yl] (E)-2-methylbut-2-enoate.
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