Chem
J-GLOBAL ID：200907062245364992   Nikkaji number：J1.913.713I

(2S)-2α-[(3S,4R)-3-Methyl-4-(mesyloxy)-5-(4-methoxybenzyloxy)pentyl]-2-methoxy-5α-methyl-6α-(4-methoxybenzyloxymethyl)tetrahydro-2H-pyran

(2S)-2α-[(3S,4R)-3-メチル-4-(メシルオキシ)-5-(4-メトキシベンジルオキシ)ペンチル]-2-メトキシ-5α-メチル-6α-(4-メトキシベンジルオキシメチル)テトラヒドロ-2H-ピラン
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： C31H46O9S
Molecular formula furigana： C31-H46-O9-S
Molecular weight： 594.760
InChI： InChI=1S/C31H46O9S/c1-23-15-17-31(36-5,39-29(23)21-37-19-25-7-11-27(34-3)12-8-25)18-16-24(2)30(40-41(6,32)33)22-38-20-26-9-13-28(35-4)14-10-26/h7-14,23-24,29-30H,15-22H2,1-6H3/t23-,24-,29-,30-,31-/m0/s1
InChI key： WPOHCRVDBLNBFF-RMRAHUOJSA-N
SMILES： COc1ccc(COC[C@H](OS(=O)(=O)C)[C@@H](C)CC[C@@]2(CC[C@H](C)[C@H](COCc3ccc(OC)cc3)O2)OC)cc1
Systematic name  (3)：
  • (2S)-2α-[(3S,4R)-3-メチル-4-(メシルオキシ)-5-(4-メトキシベンジルオキシ)ペンチル]-2-メトキシ-5α-メチル-6α-(4-メトキシベンジルオキシメチル)テトラヒドロ-2H-ピラン
  • (2R,3S)-5-[(2S,5S,6R)-2-メトキシ-6-{[(4-メトキシフェニル)メトキシ]メチル}-5-メチルオキサン-2-イル]-1-[(4-メトキシフェニル)メトキシ]-3-メチルペンタン-2-イル メタンスルホナート
  • (2R,3S)-5-[(2S,5S,6R)-2-methoxy-6-{[(4-methoxyphenyl)methoxy]methyl}-5-methyloxan-2-yl]-1-[(4-methoxyphenyl)methoxy]-3-methylpentan-2-yl methanesulfonate
Other name (1)：
  • (2S)-2α-[(3S,4R)-3-Methyl-4-(mesyloxy)-5-(4-methoxybenzyloxy)pentyl]-2-methoxy-5α-methyl-6α-(4-methoxybenzyloxymethyl)tetrahydro-2H-pyran
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