Chem
J-GLOBAL ID:200907049078310978   Nikkaji number:J2.092.654F

(15R)-Chamaepitin

(15R)-カメピチン
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: C31H46O13
Molecular formula furigana: C31-H46-O13
Molecular weight: 626.696
InChI: InChI=1S/C31H46O13/c1-14-8-24(41-19(6)34)30(12-38-17(4)32)22(29(14,7)23-9-20-10-25(36)43-28(20)42-23)11-21(35)26(31(30)13-39-31)44-27(37)15(2)16(3)40-18(5)33/h14-16,20-26,28,35-36H,8-13H2,1-7H3/t14-,15?,16?,20+,21-,22-,23+,24+,25-,26+,28-,29+,30+,31-/m1/s1
InChI key: RPBYNKFFNMBQPP-CSPCAUBZSA-N
SMILES: CC(OC(=O)C)C(C)C(=O)O[C@H]1[C@H](O)C[C@@H]2[C@@](C)([C@@H]3C[C@H]4C[C@H](O)O[C@H]4O3)[C@H](C)C[C@H](OC(=O)C)[C@@]2(COC(=O)C)[C@]21CO2
Systematic name  (3):
  • (15R)-2α,15β-ジヒドロキシ-3β-(2-メチル-3-アセトキシブタノイルオキシ)-14,15-ジヒドロ-3-デオキシカリオプチノール
  • (1R,2S,3R,4aR,5S,6R,8S,8aR)-5-[(2S,3aS,5R,6aR)-5-ヒドロキシ-ヘキサヒドロフロ[2,3-b]フラン-2-イル]-8-(アセチルオキシ)-8a-[(アセチルオキシ)メチル]-3-ヒドロキシ-5,6-ジメチル-オクタヒドロ-2H-スピロ[ナフタレン-1,2'-オキシラン]-2-イル 3-(アセチルオキシ)-2-メチルブタノアート
  • (1R,2S,3R,4aR,5S,6R,8S,8aR)-5-[(2S,3aS,5R,6aR)-5-hydroxy-hexahydrofuro[2,3-b]furan-2-yl]-8-(acetyloxy)-8a-[(acetyloxy)methyl]-3-hydroxy-5,6-dimethyl-octahydro-2H-spiro[naphthalene-1,2'-oxiran]-2-yl 3-(acetyloxy)-2-methylbutanoate
Other name (3):
  • (15R)-2α,15β-Dihydroxy-3β-(2-methyl-3-acetoxybutanoyloxy)-14,15-dihydro-3-deoxycaryoptinol
  • (15R)-カメピチン
  • (15R)-Chamaepitin
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