Chem
J-GLOBAL ID:200907024723726693
Nikkaji number:J1.893.051J
1-O-Dodecyl-3-O-allyl-4-O,6-O-benzylidene-β-D-galactopyranose 2-benzoate
1-O-ドデシル-3-O-アリル-4-O,6-O-ベンジリデン-β-D-ガラクトピラノース2-ベンゾアート
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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:
C35 H48 O7
Molecular formula furigana:
C35-H48-O7
Molecular weight:
580.762
InChI:
InChI=1S/C35H48O7/c1-3-5-6-7-8-9-10-11-12-19-25-38-35-32(41-33(36)27-20-15-13-16-21-27)31(37-24-4-2)30-29(40-35)26-39-34(42-30)28-22-17-14-18-23-28/h4,13-18,20-23,29-32,34-35H,2-3,5-12,19,24-26H2,1H3/t29-,30+,31+,32-,34?,35-/m1/s1
InChI key:
QWUKZXHAOQGPOR-VMWDKRNKSA-N
SMILES:
CCCCCCCCCCCCO[C@@H]1O[C@@H]2COC(O[C@@H]2[C@H](OCC=C)[C@H]1OC(=O)c1ccccc1)c1ccccc1
Systematic name (3):
1-O-ドデシル-3-O-アリル-4-O,6-O-ベンジリデン-β-D-ガラクトピラノース2-ベンゾアート
(4aR,6R,7R,8S,8aS)-6-(ドデシルオキシ)-2-フェニル-8-(プロパ-2-エン-1-イルオキシ)-ヘキサヒドロ-2H-ピラノ[3,2-d][1,3]ジオキシン-7-イル ベンゾアート
(4aR,6R,7R,8S,8aS)-6-(dodecyloxy)-2-phenyl-8-(prop-2-en-1-yloxy)-hexahydro-2H-pyrano[3,2-d][1,3]dioxin-7-yl benzoate
Other name (1):
1-O-Dodecyl-3-O-allyl-4-O,6-O-benzylidene-β-D-galactopyranose 2-benzoate
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