Chem
J-GLOBAL ID:200907049000104514   Nikkaji number:J1.148.525A

(5α)-6β,12,16-Trihydroxy-15-oxo-15,16-epoxycleroda-3,13-diene-19-oic acid γ-lactone

(5α)-6β,12,16-トリヒドロキシ-15-オキソ-15,16-エポキシクレロダ-3,13-ジエン-19-酸γ-ラクトン
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: C20H26O6
Molecular formula furigana: C20-H26-O6
Molecular weight: 362.422
InChI: InChI=1S/C20H26O6/c1-10-7-15-20(3)12(18(24)25-15)5-4-6-14(20)19(10,2)9-13(21)11-8-16(22)26-17(11)23/h5,8,10,13-15,17,21,23H,4,6-7,9H2,1-3H3/t10-,13?,14-,15+,17?,19+,20-/m0/s1
InChI key: PPIOYTLGGDQDKQ-YLEVIRCESA-N
SMILES: C[C@H]1C[C@H]2OC(=O)C3=CCC[C@H]([C@@]23C)[C@]1(C)CC(O)C1=CC(=O)OC1O
Systematic name  (3):
  • (5α)-6β,12,16-トリヒドロキシ-15-オキソ-15,16-エポキシクレロダ-3,13-ジエン-19-酸γ-ラクトン
  • (1R,8S,9R,10S,12R)-9-[2-ヒドロキシ-2-(2-ヒドロキシ-5-オキソ-2,5-ジヒドロフラン-3-イル)エチル]-9,10,12-トリメチル-2-オキサトリシクロ[6.3.1.04,12]ドデカ-4-エン-3-オン
  • (1R,8S,9R,10S,12R)-9-[2-hydroxy-2-(2-hydroxy-5-oxo-2,5-dihydrofuran-3-yl)ethyl]-9,10,12-trimethyl-2-oxatricyclo[6.3.1.04,12]dodec-4-en-3-one
Other name (1):
  • (5α)-6β,12,16-Trihydroxy-15-oxo-15,16-epoxycleroda-3,13-diene-19-oic acid γ-lactone
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