Chem
J-GLOBAL ID:200907050184598423   Nikkaji number:J489.678E

Picrodendrin O

ピクロデンドリンO
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: C20H28O8
Molecular formula furigana: C20-H28-O8
Molecular weight: 396.436
InChI: InChI=1S/C20H28O8/c1-7(2)10-11-17(23)26-12(10)13(25-5)18(4)19(14-15(27-14)20(11,18)24)6-9(8(3)21)16(22)28-19/h7-15,21,24H,6H2,1-5H3/t8?,9-,10-,11+,12+,13+,14+,15-,18-,19+,20-/m0/s1
InChI key: ZZBIHAVENDMJFR-BUBJQDPGSA-N
SMILES: CO[C@@H]1[C@@H]2OC(=O)[C@@H]([C@@H]2C(C)C)[C@]2(O)[C@H]3O[C@H]3[C@]3(C[C@@H](C(C)O)C(=O)O3)[C@]12C
Systematic name  (3):
  • (1S)-2α,3α-エポキシ-3aα,6β-ジヒドロキシ-4′β-(1-ヒドロキシエチル)-7β-メトキシ-7aα-メチル-5α-(1-メチルエチル)-5′-オキソスピロ[ヒドリンダン-1,2′-オキソラン]-4β-カルボン酸4,6-ラクトン
  • (1'S,2S,2'R,3'S,4S,5'R,7'R,8'S,9'R,12'S)-2'-ヒドロキシ-4-(1-ヒドロキシエチル)-8'-メトキシ-7'-メチル-12'-(プロパン-2-イル)-4',10'-ジオキサスピロ[オキソラン-2,6'-テトラシクロ[7.2.1.02,7.03,5]ドデカン]-5,11'-ジオン
  • (1'S,2S,2'R,3'S,4S,5'R,7'R,8'S,9'R,12'S)-2'-hydroxy-4-(1-hydroxyethyl)-8'-methoxy-7'-methyl-12'-(propan-2-yl)-4',10'-dioxaspiro[oxolane-2,6'-tetracyclo[7.2.1.02,7.03,5]dodecane]-5,11'-dione
Other name (3):
  • ピクロデンドリンO
  • Picrodendrin O
  • (1S)-2α,3α-Epoxy-3aα,6β-dihydroxy-4′β-(1-hydroxyethyl)-7β-methoxy-7aα-methyl-5α-(1-methylethyl)-5′-oxospiro[hydrindane-1,2′-oxolane]-4β-carboxylic acid 4,6-lactone
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