Chem
J-GLOBAL ID：201807001873741470   Nikkaji number：J3.680.363K

Isodonterpene II

イソドンテルペンII
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： C26H40O11
Molecular formula furigana： C26-H40-O11
Molecular weight： 528.595
InChI： InChI=1S/C26H40O11/c1-10-11-6-12(28)18-24-9-35-26(34,25(18,7-11)20(10)32)21(33)19(24)23(2,3)5-4-14(24)37-22-17(31)16(30)15(29)13(8-27)36-22/h11-22,27-34H,1,4-9H2,2-3H3/t11-,12+,13-,14-,15-,16+,17-,18+,19-,20-,21+,22+,24+,25+,26-/m1/s1
InChI key： GYRNCWZJVWBWNR-GTZFPMPXSA-N
SMILES： CC1(C)CC[C@@H](O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)[C@]23CO[C@](O)([C@@H](O)[C@H]12)[C@@]12C[C@@H](C[C@H](O)[C@@H]31)C(=C)[C@H]2O
Systematic name  (3)：
  • 7,20-エポキシ-6β,7β,11β,15β-テトラヒドロキシカウラ-16-エン-1β-イルβ-D-グルコピラノシド
  • (1S,2S,3S,5S,7R,8S,9S,10S,11R,15R)-12,12-ジメチル-6-メチリデン-15-{[(2R,3R,4S,5S,6R)-3,4,5-トリヒドロキシ-6-(ヒドロキシメチル)オキサン-2-イル]オキシ}-17-オキサペンタシクロ[7.6.2.15,8.01,11.02,8]オクタデカン-3,7,9,10-テトラオール
  • (1S,2S,3S,5S,7R,8S,9S,10S,11R,15R)-12,12-dimethyl-6-methylidene-15-{[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-17-oxapentacyclo[7.6.2.15,8.01,11.02,8]octadecane-3,7,9,10-tetrol
Other name (3)：
  • 7,20-Epoxy-6β,7β,11β,15β-tetrahydroxykaura-16-ene-1β-yl β-D-glucopyranoside
  • イソドンテルペンII
  • Isodonterpene II
Thsaurus map：
Thesaurus Map

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