Chem
J-GLOBAL ID：200907034190061312   Nikkaji number：J2.105.584K

Oleana-12-ene-1β,3β,11α,28-tetrol

オレアナ-12-エン-1β,3β,11α,28-テトラオール
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： C30H50O4
Molecular formula furigana： C30-H50-O4
Molecular weight： 474.726
InChI： InChI=1S/C30H50O4/c1-25(2)10-12-30(17-31)13-11-27(5)18(19(30)16-25)14-20(32)24-28(27,6)9-8-21-26(3,4)22(33)15-23(34)29(21,24)7/h14,19-24,31-34H,8-13,15-17H2,1-7H3/t19-,20+,21-,22-,23+,24-,27+,28+,29+,30+/m0/s1
InChI key： JHLQPIBNWILPOI-TWAIRLKRSA-N
SMILES： CC1(C)CC[C@]2(CO)CC[C@]3(C)C(=C[C@@H](O)[C@@H]4[C@@]5(C)[C@H](O)C[C@H](O)C(C)(C)[C@@H]5CC[C@@]34C)[C@@H]2C1
Systematic name  (3)：
  • オレアナ-12-エン-1β,3β,11α,28-テトラオール
  • (1R,3S,4aS,6aR,6bS,8aS,12aS,14R,14aS,14bS)-8a-(ヒドロキシメチル)-4,4,6a,6b,11,11,14b-ヘプタメチル-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-イコサヒドロピセン-1,3,14-トリオール
  • (1R,3S,4aS,6aR,6bS,8aS,12aS,14R,14aS,14bS)-8a-(hydroxymethyl)-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicene-1,3,14-triol
Other name (1)：
  • Oleana-12-ene-1β,3β,11α,28-tetrol
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