Chem
J-GLOBAL ID:200907051060963600   Nikkaji number:J2.429.193F

(20S,24R)-20,24-Epoxy-3β-(β-D-glucopyranosyloxy)dammarane-11,25-diol

(20S,24R)-20,24-エポキシ-3β-(β-D-グルコピラノシルオキシ)ダンマラン-11,25-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: C36H62O9
Molecular formula furigana: C36-H62-O9
Molecular weight: 638.883
InChI: InChI=1S/C36H62O9/c1-31(2)23-10-15-35(7)29(33(23,5)13-11-24(31)44-30-28(41)27(40)26(39)22(18-37)43-30)21(38)17-20-19(9-14-34(20,35)6)36(8)16-12-25(45-36)32(3,4)42/h19-30,37-42H,9-18H2,1-8H3/t19-,20+,21?,22+,23-,24-,25+,26+,27-,28+,29+,30-,33-,34+,35+,36-/m0/s1
InChI key: RJWRXQPFFDUAGL-WXZZEWTISA-N
SMILES: CC(C)(O)[C@H]1CC[C@](C)(O1)[C@H]1CC[C@]2(C)[C@@H]1CC(O)[C@@H]1[C@@]3(C)CC[C@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)C(C)(C)[C@@H]3CC[C@@]21C
Systematic name  (3):
  • (20S,24R)-20,24-エポキシ-3β-(β-D-グルコピラノシルオキシ)ダンマラン-11,25-ジオール
  • (2R,3R,4S,5S,6R)-2-{[(1S,3aR,3bR,5aR,7S,9aS,9bR,11aR)-10-ヒドロキシ-1-[(2S,5R)-5-(2-ヒドロキシプロパン-2-イル)-2-メチルオキソラン-2-イル]-3a,3b,6,6,9a-ペンタメチル-ヘキサデカヒドロ-1H-シクロペンタ[a]フェナントレン-7-イル]オキシ}-6-(ヒドロキシメチル)オキサン-3,4,5-トリオール
  • (2R,3R,4S,5S,6R)-2-{[(1S,3aR,3bR,5aR,7S,9aS,9bR,11aR)-10-hydroxy-1-[(2S,5R)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-3a,3b,6,6,9a-pentamethyl-hexadecahydro-1H-cyclopenta[a]phenanthren-7-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
Other name (1):
  • (20S,24R)-20,24-Epoxy-3β-(β-D-glucopyranosyloxy)dammarane-11,25-diol
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