Chem
J-GLOBAL ID：200907085915309939   Nikkaji number：J719.358K

3-O-Acetylryanodol

リアノドール3-アセタート
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： C22H34O9
Molecular formula furigana： C22-H34-O9
Molecular weight： 442.505
InChI： InChI=1S/C22H34O9/c1-10(2)19(27)14(30-12(4)23)20(28)15(5)9-18(26)16(19,6)22(20,29)21(31-18)13(24)11(3)7-8-17(15,21)25/h10-11,13-14,24-29H,7-9H2,1-6H3/t11-,13+,14+,15-,16-,17-,18-,19+,20+,21+,22+/m0/s1
InChI key： NWYLABHZILHMRR-CEHBMGNCSA-N
SMILES： CC(C)[C@@]1(O)[C@@H](OC(=O)C)[C@@]2(O)[C@@]3(C)C[C@]4(O)O[C@@]5([C@H](O)[C@@H](C)CC[C@]35O)[C@@]2(O)[C@]14C
Systematic name  (4)：
  • リアノドール3-アセタート
  • 3-O-アセチルリアノドール
  • (1R,2R,3S,6S,7S,9S,10S,11S,12R,13S,14R)-2,6,9,11,13,14-ヘキサヒドロキシ-3,7,10-トリメチル-11-(プロパン-2-イル)-15-オキサペンタシクロ[7.5.1.01,6.07,13.010,14]ペンタデカン-12-イル アセタート
  • (1R,2R,3S,6S,7S,9S,10S,11S,12R,13S,14R)-2,6,9,11,13,14-hexahydroxy-3,7,10-trimethyl-11-(propan-2-yl)-15-oxapentacyclo[7.5.1.01,6.07,13.010,14]pentadecan-12-yl acetate
Other name (2)：
  • Ryanodol 3-acetate
  • 3-O-Acetylryanodol
Thsaurus map：
Thesaurus Map

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