(1α,4aα,4bβ,6α,10β)-4a-Formyl-6-hydroxy-1-methyl-8-methylenegibbane-1,10-dicarboxylic acid
CAS Registry Number®
137694-17-8
CAS Name
(1α,4aα,4bβ,6α,10β)-4a-Formyl-6-hydroxy-1-methyl-8-methylenegibbane-1,10-dicarboxylic acidMolecular Formula
C20H26O6Molecular Mass
362.42Cite this Page
(1α,4aα,4bβ,6α,10β)-4a-Formyl-6-hydroxy-1-methyl-8-methylenegibbane-1,10-dicarboxylic acid. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=137694-17-8 (retrieved ) (CAS RN: 137694-17-8). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C20H26O6/c1-10-7-20-8-11(10)12(22)6-13(20)19(9-21)5-3-4-18(2,17(25)26)15(19)14(20)16(23)24/h9,11-15,22H,1,3-8H2,2H3,(H,23,24)(H,25,26)/t11-,12+,13+,14-,15-,18-,19-,20+/m1/s1
InChIKey
InChIKey=ABTNJGAZZKYLLD-SQLMURCQSA-N
SMILES
C(O)(=O)[C@@H]1[C@]23[C@]([C@@]4(C=O)[C@]1([C@@](C(O)=O)(C)CCC4)[H])(C[C@H](O)[C@](C2)(C(=C)C3)[H])[H]
Canonical SMILES
O=CC12CCCC(C(=O)O)(C)C2C(C(=O)O)C34CC(=C)C(C3)C(O)CC14
Other Names for this Substance
- Gibbane-1,10-dicarboxylic acid, 4a-formyl-6-hydroxy-1-methyl-8-methylene-, (1α,4aα,4bβ,6α,10β)-
- 1H-7,9a-Methanobenz[a]azulene, gibbane-1,10-dicarboxylic acid deriv.
- (1α,4aα,4bβ,6α,10β)-4a-Formyl-6-hydroxy-1-methyl-8-methylenegibbane-1,10-dicarboxylic acid
- Gibberellin A115