Chem
J-GLOBAL ID：200907058569410396   Nikkaji number：J1.918.499D

1β(11)-Oxyabieta-8,11,13-triene-6β,7α,12-triol

1β(11)-オキシアビエタ-8,11,13-トリエン-6β,7α,12-トリオール
Substance type：
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula： C20H28O4
Molecular formula furigana： C20-H28-O4
Molecular weight： 332.440
InChI： InChI=1S/C20H28O4/c1-9(2)10-8-11-13-17(15(10)22)24-12-6-7-19(3,4)18(20(12,13)5)16(23)14(11)21/h8-9,12,14,16,18,21-23H,6-7H2,1-5H3/t12-,14+,16-,18+,20-/m1/s1
InChI key： TWSYYCFHPMSRBL-WDCXWOBVSA-N
SMILES： CC(C)c1cc2[C@H](O)[C@@H](O)[C@@H]3[C@]4(C)[C@@H](CCC3(C)C)Oc(c24)c1O
Systematic name  (3)：
  • 1β(11)-オキシアビエタ-8,11,13-トリエン-6β,7α,12-トリオール
  • (6S,7S,8S,12R,13S)-9,9,13-トリメチル-3-(プロパン-2-イル)-15-オキサテトラシクロ[10.2.1.05,14.08,13]ペンタデカ-1,3,5(14)-トリエン-2,6,7-トリオール
  • (6S,7S,8S,12R,13S)-9,9,13-trimethyl-3-(propan-2-yl)-15-oxatetracyclo[10.2.1.05,14.08,13]pentadeca-1,3,5(14)-triene-2,6,7-triol
Other name (1)：
  • 1β(11)-Oxyabieta-8,11,13-triene-6β,7α,12-triol
Thsaurus map：
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