Gibbane-1,4a,10-tricarboxylic acid, 2,6-dihydroxy-1-methyl-8-methylene-, (1α,2β,4aα,4bβ,6α,10β)-

CAS Registry Number®

57672-81-8

CAS Name

Gibbane-1,4a,10-tricarboxylic acid, 2,6-dihydroxy-1-methyl-8-methylene-, (1α,2β,4aα,4bβ,6α,10β)-

Molecular Formula

C20H26O8

Molecular Mass

394.42

Cite this Page

Gibbane-1,4a,10-tricarboxylic acid, 2,6-dihydroxy-1-methyl-8-methylene-, (1α,2β,4aα,4bβ,6α,10β)-.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=57672-81-8 (retrieved 2024-11-08) (CAS RN: 57672-81-8).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H26O8/c1-8-6-19-7-9(8)10(21)5-11(19)20(17(27)28)4-3-12(22)18(2,16(25)26)14(20)13(19)15(23)24/h9-14,21-22H,1,3-7H2,2H3,(H,23,24)(H,25,26)(H,27,28)/t9-,10+,11-,12+,13-,14-,18-,19+,20-/m1/s1

InChIKey

InChIKey=LKLDZCIWUDJQCF-OZPHONOWSA-N

SMILES

C(O)(=O)[C@@H]1[C@]23[C@]([C@@]4(C(O)=O)[C@]1([C@@](C(O)=O)(C)[C@@H](O)CC4)[H])(C[C@H](O)[C@](C2)(C(=C)C3)[H])[H]

Canonical SMILES

O=C(O)C1C2C(C(=O)O)(C)C(O)CCC2(C(=O)O)C3CC(O)C4C(=C)CC13C4

Other Names for this Substance

  • Gibbane-1,4a,10-tricarboxylic acid, 2,6-dihydroxy-1-methyl-8-methylene-, (1α,2β,4aα,4bβ,6α,10β)-
  • 4aH-7,9a-Methanobenz[a]azulene, gibbane-1,4a,10-tricarboxylic acid deriv.
  • Gibberellin A39

CAS INSIGHTSTM
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