Chem
J-GLOBAL ID:200907044849406881   Nikkaji number:J2.136.594G

Thymuside A

チムシドA
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: C16H26O7
Molecular formula furigana: C16-H26-O7
Molecular weight: 330.377
InChI: InChI=1S/C16H26O7/c1-8(2)9-4-5-15(3)11(6-9)22-16(20)13(19)12(18)10(7-17)21-14(16)23-15/h4,8,10-14,17-20H,5-7H2,1-3H3/t10-,11-,12-,13+,14+,15-,16+/m1/s1
InChI key: CSCBRJMLQJUDBK-HHYIAMCXSA-N
SMILES: CC(C)C1=CC[C@@]2(C)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@]3(O)O[C@@H]2C1
Systematic name  (3):
  • (2R,3S,4S,4aS,5aR,9aR,10aS)-3,4,4a-トリヒドロキシ-3,4,4a,5a,6,9,9a,10a-オクタヒドロ-7-イソプロピル-9a-メチル-2H-ピラノ[2,3-b][1,4]ベンゾジオキシン-2-メタノール
  • (1R,3S,5R,6S,7S,8S,10R)-5-(ヒドロキシメチル)-1-メチル-12-(プロパン-2-イル)-2,4,9-トリオキサトリシクロ[8.4.0.03,8]テトラデカ-12-エン-6,7,8-トリオール
  • (1R,3S,5R,6S,7S,8S,10R)-5-(hydroxymethyl)-1-methyl-12-(propan-2-yl)-2,4,9-trioxatricyclo[8.4.0.03,8]tetradec-12-ene-6,7,8-triol
Other name (3):
  • (2R,3S,4S,4aS,5aR,9aR,10aS)-3,4,4a-Trihydroxy-3,4,4a,5a,6,9,9a,10a-octahydro-7-isopropyl-9a-methyl-2H-pyrano[2,3-b][1,4]benzodioxin-2-methanol
  • チムシドA
  • Thymuside A
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