Chem
J-GLOBAL ID：200907008645550766   Nikkaji number：J1.893.039K

1-(Isopropylthio)-6-O-allyl-1-deoxy-β-D-galactopyranose 2,3,4-tribenzoate

1-(イソプロピルチオ)-6-O-アリル-1-デオキシ-β-D-ガラクトピラノース2,3,4-トリベンゾアート
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： C33H34O8S
Molecular formula furigana： C33-H34-O8-S
Molecular weight： 590.690
InChI： InChI=1S/C33H34O8S/c1-4-20-37-21-26-27(39-30(34)23-14-8-5-9-15-23)28(40-31(35)24-16-10-6-11-17-24)29(33(38-26)42-22(2)3)41-32(36)25-18-12-7-13-19-25/h4-19,22,26-29,33H,1,20-21H2,2-3H3/t26-,27+,28+,29-,33+/m1/s1
InChI key： PRLJOKADWSODNX-AZLQSNHZSA-N
SMILES： CC(C)S[C@@H]1O[C@H](COCC=C)[C@H](OC(=O)c2ccccc2)[C@H](OC(=O)c2ccccc2)[C@H]1OC(=O)c1ccccc1
Systematic name  (3)：
  • 1-(イソプロピルチオ)-6-O-アリル-1-デオキシ-β-D-ガラクトピラノース2,3,4-トリベンゾアート
  • (2R,3S,4S,5R,6S)-4,5-ビス(ベンゾイルオキシ)-2-[(プロパ-2-エン-1-イルオキシ)メチル]-6-(プロパン-2-イルスルファニル)オキサン-3-イル ベンゾアート
  • (2R,3S,4S,5R,6S)-4,5-bis(benzoyloxy)-2-[(prop-2-en-1-yloxy)methyl]-6-(propan-2-ylsulfanyl)oxan-3-yl benzoate
Other name (1)：
  • 1-(Isopropylthio)-6-O-allyl-1-deoxy-β-D-galactopyranose 2,3,4-tribenzoate
Thsaurus map：
Thesaurus Map

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