(3S,5aR,6R,7aS,14aR,14bR)-6-(Acetyloxy)-1,2,3,6,7,7a,10,14,14a,14b-decahydro-3,13-dimethoxy-5,5,7a,9,14b-pentamethyl-5H-3,5a-epoxy-12H-furo[3,4-i]oxepino[4,3-a]xanthen-12-one
CAS Registry Number®
81543-01-3
CAS Name
(3S,5aR,6R,7aS,14aR,14bR)-6-(Acetyloxy)-1,2,3,6,7,7a,10,14,14a,14b-decahydro-3,13-dimethoxy-5,5,7a,9,14b-pentamethyl-5H-3,5a-epoxy-12H-furo[3,4-i]oxepino[4,3-a]xanthen-12-oneMolecular Formula
C28H36O9Molecular Mass
516.58Cite this Page
(3S,5aR,6R,7aS,14aR,14bR)-6-(Acetyloxy)-1,2,3,6,7,7a,10,14,14a,14b-decahydro-3,13-dimethoxy-5,5,7a,9,14b-pentamethyl-5H-3,5a-epoxy-12H-furo[3,4-i]oxepino[4,3-a]xanthen-12-one. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=81543-01-3 (retrieved ) (CAS RN: 81543-01-3). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C28H36O9/c1-14-17-13-33-23(30)20(17)22(31-7)16-11-18-25(5)9-10-27(32-8)36-24(3,4)28(25,37-27)19(34-15(2)29)12-26(18,6)35-21(14)16/h18-19H,9-13H2,1-8H3/t18-,19-,25-,26+,27+,28-/m1/s1
InChIKey
InChIKey=JVCNHGXAVMINTN-QBNAFFQBSA-N
SMILES
C[C@]12[C@]3([C@H](OC(C)=O)C[C@@]4(C)[C@@]1(CC=5C(O4)=C(C)C6=C(C5OC)C(=O)OC6)[H])O[C@@](OC)(OC3(C)C)CC2
Canonical SMILES
O=C1OCC2=C1C(OC)=C3C(OC4(C)CC(OC(=O)C)C56OC(OC)(OC5(C)C)CCC6(C)C4C3)=C2C
Other Names for this Substance
- 5H-3,5a-Epoxy-12H-furo[3,4-i]oxepino[4,3-a]xanthen-12-one, 6-(acetyloxy)-1,2,3,6,7,7a,10,14,14a,14b-decahydro-3,13-dimethoxy-5,5,7a,9,14b-pentamethyl-, (3S,5aR,6R,7aS,14aR,14bR)-
- 12H-3,5a-Epoxy-5H-furo[3,4-i]oxepino[4,3-a]xanthen-12-one, 6-(acetyloxy)-1,2,3,6,7,7a,10,14,14a,14b-decahydro-3,13-dimethoxy-5,5,7a,9,14b-pentamethyl-, [3S-(3α,5aα,6β,7aα,14aα,14bβ)]-
- 12H-3,5a-Epoxy-5H-furo[3,4-i]oxepino[4,3-a]xanthen-12-one, 6-(acetyloxy)-1,2,3,6,7,7a,10,14,14a,14b-decahydro-3,13-dimethoxy-5,5,7a,9,14b-pentamethyl-, (3S,5aR,6R,7aS,14aR,14bR)-
- (3S,5aR,6R,7aS,14aR,14bR)-6-(Acetyloxy)-1,2,3,6,7,7a,10,14,14a,14b-decahydro-3,13-dimethoxy-5,5,7a,9,14b-pentamethyl-5H-3,5a-epoxy-12H-furo[3,4-i]oxepino[4,3-a]xanthen-12-one
- Austalide A