(3aS,4S,4aS,5R,7S,7aS,9aS)-7-(Acetyloxy)-3a,4,4a,5,6,7,7a,9a-octahydro-4,5-dihydroxy-5,8-dimethyl-3-methyleneazuleno[6,5-b]furan-2(3H)-one
CAS Registry Number®
1333396-75-0
CAS Name
(3aS,4S,4aS,5R,7S,7aS,9aS)-7-(Acetyloxy)-3a,4,4a,5,6,7,7a,9a-octahydro-4,5-dihydroxy-5,8-dimethyl-3-methyleneazuleno[6,5-b]furan-2(3H)-oneMolecular Formula
C17H22O6Molecular Mass
322.35Cite this Page
(3aS,4S,4aS,5R,7S,7aS,9aS)-7-(Acetyloxy)-3a,4,4a,5,6,7,7a,9a-octahydro-4,5-dihydroxy-5,8-dimethyl-3-methyleneazuleno[6,5-b]furan-2(3H)-one. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=1333396-75-0 (retrieved ) (CAS RN: 1333396-75-0). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C17H22O6/c1-7-5-10-13(8(2)16(20)23-10)15(19)14-12(7)11(22-9(3)18)6-17(14,4)21/h5,10-15,19,21H,2,6H2,1,3-4H3/t10-,11-,12-,13+,14-,15-,17+/m0/s1
InChIKey
InChIKey=WCZBMGWSWYHCAA-PDNFSXIVSA-N
SMILES
O(C(C)=O)[C@@H]1[C@]2([C@@]([C@@H](O)[C@]3([C@](C=C2C)(OC(=O)C3=C)[H])[H])([C@](C)(O)C1)[H])[H]
Canonical SMILES
O=C1OC2C=C(C)C3C(OC(=O)C)CC(O)(C)C3C(O)C2C1=C
Other Names for this Substance
- Azuleno[6,5-b]furan-2(3H)-one, 7-(acetyloxy)-3a,4,4a,5,6,7,7a,9a-octahydro-4,5-dihydroxy-5,8-dimethyl-3-methylene-, (3aS,4S,4aS,5R,7S,7aS,9aS)-
- (3aS,4S,4aS,5R,7S,7aS,9aS)-7-(Acetyloxy)-3a,4,4a,5,6,7,7a,9a-octahydro-4,5-dihydroxy-5,8-dimethyl-3-methyleneazuleno[6,5-b]furan-2(3H)-one