Chem
J-GLOBAL ID：200907017110827059   Nikkaji number：J999.562E

23-O-Acetyl-7β-hydroxyshengmanol xylosdide

23-O-アセチル-7β-ヒドロキシシェングマノールキシロシド
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： C37H58O11
Molecular formula furigana： C37-H58-O11
Molecular weight： 678.860
InChI： InChI=1S/C37H58O11/c1-17(13-21(46-18(2)38)30-33(5,6)48-30)24-26(42)29(44)35(8)28-19(39)14-22-32(3,4)23(47-31-27(43)25(41)20(40)15-45-31)9-10-36(22)16-37(28,36)12-11-34(24,35)7/h17,19-25,27-31,39-41,43-44H,9-16H2,1-8H3/t17-,19+,20-,21+,22+,23+,24+,25+,27-,28+,29?,30-,31+,34-,35-,36-,37+/m1/s1
InChI key： RXFQHRCATQKWNA-DFGDIYSLSA-N
SMILES： C[C@H](C[C@H](OC(=O)C)[C@H]1OC1(C)C)[C@H]1C(=O)C(O)[C@@]2(C)[C@@H]3[C@@H](O)C[C@@H]4[C@]5(C[C@@]35CC[C@]12C)CC[C@H](O[C@@H]1OC[C@@H](O)[C@H](O)[C@H]1O)C4(C)C
Systematic name  (3)：
  • [(23S,24R)-23-アセトキシ-24,25-エポキシ-7β,15-ジヒドロキシ-16-オキソ-9β,19-シクロ-5α-ラノスタン-3β-イル]β-D-キシロピラノシド
  • (1S,3R)-3-[(1S,3R,6S,8R,10S,11R,12S,15R,16R)-10,13-ジヒドロキシ-7,7,12,16-テトラメチル-14-オキソ-6-{[(2S,3R,4S,5R)-3,4,5-トリヒドロキシオキサン-2-イル]オキシ}ペンタシクロ[9.7.0.01,3.03,8.012,16]オクタデカン-15-イル]-1-[(2R)-3,3-ジメチルオキシラン-2-イル]ブチル アセタート
  • (1S,3R)-3-[(1S,3R,6S,8R,10S,11R,12S,15R,16R)-10,13-dihydroxy-7,7,12,16-tetramethyl-14-oxo-6-{[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy}pentacyclo[9.7.0.01,3.03,8.012,16]octadecan-15-yl]-1-[(2R)-3,3-dimethyloxiran-2-yl]butyl acetate
Other name (3)：
  • [(23S,24R)-23-Acetoxy-24,25-epoxy-7β,15-dihydroxy-16-oxo-9β,19-cyclo-5α-lanostane-3β-yl]β-D-xylopyranoside
  • 23-O-アセチル-7β-ヒドロキシシェングマノールキシロシド
  • 23-O-Acetyl-7β-hydroxyshengmanol xylosdide
Thsaurus map：
Thesaurus Map

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