Anabsin

CAS Registry Number®

72542-39-3

CAS Name

Anabsin

Molecular Formula

C30H40O7

Molecular Mass

512.63

Cite this Page

Anabsin.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=72542-39-3 (retrieved 2024-11-22) (CAS RN: 72542-39-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C30H40O7/c1-11-14-7-9-27(4,34)20-16(21(14)35-25(11)32)13(3)19-17(20)18-22-28(5)10-8-15-12(2)26(33)36-24(15)30(19,22)29(6,37-28)23(18)31/h11-12,14-15,17-24,31,34H,7-10H2,1-6H3/t11-,12-,14-,15-,17-,18+,19-,20-,21-,22-,23-,24-,27-,28-,29-,30-/m0/s1

InChIKey

InChIKey=OVZIMEDUADJHPN-BLQGRMASSA-N

SMILES

C[C@@]12[C@]34[C@@]([C@@]([C@]5([C@@]3(C(C)=C6[C@@]5([C@@](C)(O)CC[C@@]7([C@@]6(OC(=O)[C@H]7C)[H])[H])[H])[H])[H])([C@@H]1O)[H])([C@@](C)(O2)CC[C@@]8([C@@]4(OC(=O)[C@H]8C)[H])[H])[H]

Canonical SMILES

O=C1OC2C3=C(C)C4C(C3C(O)(C)CCC2C1C)C5C(O)C6(OC7(C)CCC8C(C(=O)OC8C46C57)C)C

Other Names for this Substance

  • 2H-8,15-Epoxy-7,13b-ethanopentaleno[1′′,2′′:6,7;5′′,4′′:6′,7′]dicyclohepta[1,2-b:1′,2′-b′]difuran-2,12(11H)-dione, 3,3a,4,5,6,6a,6b,7,7a,8,9,10,10a,13a,13c,14b-hexadecahydro-6,16-dihydroxy-3,6,8,11,14,15-hexamethyl-, (3S,3aS,6S,6aR,6bR,7R,7aR,8S,10aS,11S,13aS,13bS,13cR,14bS,15R,16S)-
  • 2H-8,15-Epoxy-7,13b-ethanopentaleno[1′′,2′′:6,7;5′′,4′′:6′,7′]dicyclohepta[1,2-b:1′,2′-b′]difuran-2,12(11H)-dione, 3,3a,4,5,6,6a,6b,7,7a,8,9,10,10a,13a,13c,14b-hexadecahydro-6,16-dihydroxy-3,6,8,11,14,15-hexamethyl-, [3S-(3α,3aα,6β,6aα,6bβ,7α,7aβ,8α,10aβ,11β,13aα,13bα,13cβ,14bβ,15S*,16R*)]-
  • (3S,3aS,6S,6aR,6bR,7R,7aR,8S,10aS,11S,13aS,13bS,13cR,14bS,15R,16S)-3,3a,4,5,6,6a,6b,7,7a,8,9,10,10a,13a,13c,14b-Hexadecahydro-6,16-dihydroxy-3,6,8,11,14,15-hexamethyl-2H-8,15-epoxy-7,13b-ethanopentaleno[1′′,2′′:6,7;5′′,4′′:6′,7′]dicyclohepta[1,2-b:1′,2′-b′]difuran-2,12(11H)-dione
  • Anabsin

Deleted or Replaced CAS Registry Numbers

499187-57-4

CAS INSIGHTSTM
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