Chem
J-GLOBAL ID：200907033742287284   Nikkaji number：J1.149.714D

8-Acetoxylabda-12,14-diene-19-oic acid

8-アセトキシラブダ-12,14-ジエン-19-酸
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： C22H34O4
Molecular formula furigana： C22-H34-O4
Molecular weight： 362.510
InChI： InChI=1S/C22H34O4/c1-7-15(2)9-10-18-20(4)12-8-13-21(5,19(24)25)17(20)11-14-22(18,6)26-16(3)23/h7,9,17-18H,1,8,10-14H2,2-6H3,(H,24,25)/t17-,18-,20+,21+,22-/m1/s1
InChI key： HOHBIMRJPJCLGU-OPNZPCBVSA-N
SMILES： CC(=O)O[C@]1(C)CC[C@@H]2[C@](C)(CCC[C@]2(C)C(=O)O)[C@H]1CC=C(C)C=C
Systematic name  (3)：
  • 8-アセトキシラブダ-12,14-ジエン-19-酸
  • (1S,4aS,5R,6R,8aR)-6-(アセチルオキシ)-1,4a,6-トリメチル-5-(3-メチルペンタ-2,4-ジエン-1-イル)-デカヒドロナフタレン-1-カルボン酸
  • (1S,4aS,5R,6R,8aR)-6-(acetyloxy)-1,4a,6-trimethyl-5-(3-methylpenta-2,4-dien-1-yl)-decahydronaphthalene-1-carboxylic acid
Other name (1)：
  • 8-Acetoxylabda-12,14-diene-19-oic acid
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