(1α,2β,4aα,4bβ,10β)-10-Formyl-2-hydroxy-1,4a-dimethyl-8-methylenegibbane-1-carboxylic acid

CAS Registry Number®

35470-76-9

CAS Name

(1α,2β,4aα,4bβ,10β)-10-Formyl-2-hydroxy-1,4a-dimethyl-8-methylenegibbane-1-carboxylic acid

Molecular Formula

C20H28O4

Molecular Mass

332.43

Cite this Page

(1α,2β,4aα,4bβ,10β)-10-Formyl-2-hydroxy-1,4a-dimethyl-8-methylenegibbane-1-carboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=35470-76-9 (retrieved 2024-11-04) (CAS RN: 35470-76-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C20H28O4/c1-11-8-20-9-12(11)4-5-14(20)18(2)7-6-15(22)19(3,17(23)24)16(18)13(20)10-21/h10,12-16,22H,1,4-9H2,2-3H3,(H,23,24)/t12-,13+,14+,15+,16+,18+,19-,20-/m1/s1

InChIKey

InChIKey=YMDYUWHAQBYOMU-HYAYUQHRSA-N

SMILES

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

Canonical SMILES

O=CC1C2C(C(=O)O)(C)C(O)CCC2(C)C3CCC4C(=C)CC13C4

Other Names for this Substance

  • Gibbane-1-carboxylic acid, 10-formyl-2-hydroxy-1,4a-dimethyl-8-methylene-, (1α,2β,4aα,4bβ,10β)-
  • 1H-7,9a-Methanobenz[a]azulene, gibbane-1-carboxylic acid deriv.
  • (1α,2β,4aα,4bβ,10β)-10-Formyl-2-hydroxy-1,4a-dimethyl-8-methylenegibbane-1-carboxylic acid
  • Gibberellin A14 aldehyde

CAS INSIGHTSTM
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