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Chemical structure of Sophorose monohydrate

GC72903

Sophorose monohydrate

Also known as (2R,3S,4R,5R)-3,4,5,6-tetrahydroxy-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyhexanal;hydrate

Sophorose (2-O-beta-D-Glucopyranosyl-D-glucopyranose) monodrate is the disaccharide component of microbial glycolipids, which are often used as biosurfactants due to their drophobicity

ChemicalCAS140686-17-5MW360.31FormulaC12H24O12
CAS number
140686-17-5
Molecular weight
360.31
Formula
C12H24O12
Solubility
H2O ： 125 mg/mL (346·92 mM; Need ultrasonic)
InChIKey
TVMMOAQPULJZGB-RVNRFXEQSA-N
Catalogue number
GC72903
Brand
GLPBIO
Computed properties PubChem CID 90479496 · TPSA 198 Ų · H-bond donors 9 · H-bond acceptors 12
TPSA
198 Ų
H-bond donors
9
H-bond acceptors
12
Rotatable bonds
8
Heavy atoms
24

SMILES C([C@@H]1[C@H]([C@@H]([C@H]([C@@H](O1)O[C@@H](C=O)[C@H]([C@@H]([C@@H](CO)O)O)O)O)O)O)O.O

Computed descriptors from PubChem (CID 90479496), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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