(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-one

Molecular Formula

C28H36O9

Molecular Mass

516.58

Cite 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 2024-11-22) (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

CAS INSIGHTSTM
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