67310-53-6 , Benzyl hepta-O-acetyl-b-D-lactoside, CAS:67310-53-6

67310-53-6 , Benzyl hepta-O-acetyl-b-D-lactoside,
CAS:67310-53-6
C33H42O18 / 726.69
MFCD02094217

Benzyl hepta-O-acetyl-b-D-lactoside

苄基-七-O-乙酰基-beta-D-乳糖苷,

CAS Number	67310-53-6
Product Name	[(2R,3R,4S,5R,6R)-4,5-diacetyloxy-6-phenylmethoxy-3-[(2S,3R,4S,5S,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]methyl acetate
IUPAC Name	[(2R,3R,4S,5R,6R)-4,5-diacetyloxy-6-phenylmethoxy-3-[(2S,3R,4S,5S,6R)-3,4,5-triacetyloxy-6-(acetyloxymethyl)oxan-2-yl]oxyoxan-2-yl]methyl acetate
Molecular Formula	C33H42O18
Molecular Weight	726.69 g/mol
InChI	InChI=1S/C33H42O18/c1-16(34)41-14-24-26(44-18(3)36)28(45-19(4)37)31(48-22(7)40)33(50-24)51-27-25(15-42-17(2)35)49-32(43-13-23-11-9-8-10-12-23)30(47-21(6)39)29(27)46-20(5)38/h8-12,24-33H,13-15H2,1-7H3/t24-,25-,26+,27-,28+,29+,30-,31-,32-,33+/m1/s1
InChI Key	BDMTWMBGISDBOQ-LZWHNZSHSA-N
SMILES	CC(=O)OCC1C(C(C(C(O1)OCC2=CC=CC=C2)OC(=O)C)OC(=O)C)OC3C(C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C
Synonyms	Phenylmethyl 4-O-(2,3,4,6-Tetra-O-acetyl-β-D-galactopyranosyl)-β-D-glucopyranoside Triacetate; Benzyl β-Lactoside Heptaacetate;
Canonical SMILES	CC(=O)OCC1C(C(C(C(O1)OCC2=CC=CC=C2)OC(=O)C)OC(=O)C)OC3C(C(C(C(O3)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C
Isomeric SMILES	CC(=O)OC[C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)OCC2=CC=CC=C2)OC(=O)C)OC(=O)C)O[C@H]3[C@@H]([C@H]([C@H]([C@H](O3)COC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C

CAS No: 67310-53-6 Synonyms: Benzyl 2,3,6-tri-O-acetyl-4-O-(2,3,4,6-tetra-O-acetyl-b-D-galactopyranosyl)-b-D-glucopyranoside MDL No: MFCD02094217 Chemical Formula: C33H42O18 Molecular Weight: 726.69

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