Chem
J-GLOBAL ID:200907023663253700   Nikkaji number:J15.878J

Panaxadiol

パナキサジオール
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: C30H52O3
Molecular formula furigana: C30-H52-O3
Molecular weight: 460.743
InChI: InChI=1S/C30H52O3/c1-25(2)13-9-14-30(8,33-25)19-10-16-29(7)24(19)20(31)18-22-27(5)15-12-23(32)26(3,4)21(27)11-17-28(22,29)6/h19-24,31-32H,9-18H2,1-8H3/t19-,20+,21-,22+,23-,24-,27-,28+,29+,30+/m0/s1
InChI key: PVLHOJXLNBFHDX-XHJPDDKBSA-N
SMILES: C[C@@]12CC[C@@H]([C@H]1[C@H](O)C[C@@H]1[C@@]3(C)CC[C@H](O)C(C)(C)[C@@H]3CC[C@@]21C)[C@@]1(C)CCCC(C)(C)O1
Systematic name  (4):
  • (20R)-20,25-エポキシダンマラン-3β,12β-ジオール
  • (20R)-20,25-エポキシ-5α-ダンマラン-3β,12β-ジオール
  • (1S,3aR,3bR,5aR,7S,9aR,9bR,11R,11aR)-3a,3b,6,6,9a-ペンタメチル-1-[(2R)-2,6,6-トリメチルオキサン-2-イル]-ヘキサデカヒドロ-1H-シクロペンタ[a]フェナントレン-7,11-ジオール
  • (1S,3aR,3bR,5aR,7S,9aR,9bR,11R,11aR)-3a,3b,6,6,9a-pentamethyl-1-[(2R)-2,6,6-trimethyloxan-2-yl]-hexadecahydro-1H-cyclopenta[a]phenanthrene-7,11-diol
Other name (5):
  • パナキサジオール
  • Panaxadiol
  • (20R)-20,25-Epoxy-5α-dammarane-3β,12β-diol
  • (20R)-パナキサジオール
  • (20R)-Panaxadiol
CAS registry number: 19666-76-3
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