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PRD_900076

Summary
Name:METHYL 4-O-L-GLUCOPYRANOSYL-ALPHA-L-RIBO-HEXOPYRANOSIDE
Formula:C13 H24 O11
Fomular weight:356.323
Component type:saccharide
Polymer sequences:MGL, GAL
Non-polymer components:
BIRD class:Glycan component
Represented as:branched
Description:oligosaccharide

ProgramVersionName
ACDLabs12.01methyl 4-O-beta-D-galactopyranosyl-beta-D-glucopyranoside
OpenEye OEToolkits2.0.7(2~{R},3~{R},4~{S},5~{R},6~{S})-2-(hydroxymethyl)-6-[(2~{R},3~{S},4~{R},5~{R},6~{R})-2-(hydroxymethyl)-6-methoxy-4,5-bi s(oxidanyl)oxan-3-yl]oxy-oxane-3,4,5-triol

Chemical Descriptors

TypeProgramVersionDescriptor
SMILESACDLabs12.01C1(OC(C(C(C1O)O)OC2C(C(C(C(CO)O2)O)O)O)CO)OC
InChIInChI1.03InChI=1S/C13H24O11/c1-21-12-10(20)8(18)11(5(3-15)23-12)24-13-9(19)7(17)6(16)4(2-14)22-13/h4-20H,2-3H2,1H3/t4-,5-,6+,7+, 8-,9-,10-,11-,12-,13+/m1/s1
InChIKeyInChI1.03FHNIYFZSHCGBPP-ABBMIVAOSA-N
SMILES_CANONICALCACTVS3.385CO[C@@H]1O[C@H](CO)[C@@H](O[C@@H]2O[C@H](CO)[C@H](O)[C@H](O)[C@H]2O)[C@H](O)[C@H]1O
SMILESCACTVS3.385CO[CH]1O[CH](CO)[CH](O[CH]2O[CH](CO)[CH](O)[CH](O)[CH]2O)[CH](O)[CH]1O
SMILES_CANONICALOpenEye OEToolkits2.0.7CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O)O)O)O
SMILESOpenEye OEToolkits2.0.7COC1C(C(C(C(O1)CO)OC2C(C(C(C(O2)CO)O)O)O)O)O

218853

PDB entries from 2024-04-24

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