Product Code

TRC-S676843

CAS Number

140686-17-5

Product Format

Neat

Molecular Formula

C12 H22 O11 . H2 O

Molecular Weight

360.312

Product Categories

TRC

Product Type

Bioactive Small Molecule

Price and availability

48-hour USA dispatch time

Freight restricted.

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Product Information

Chemical Data

Analyte Name

a-Sophorose Monohydrate

CAS Number

140686-17-5

Molecular Formula

C12 H22 O11 . H2 O

Molecular Weight

360.312

Accurate Mass

360.127

SMILES

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

InChI

InChI=1S/C12H22O11.H2O/c13-1-4(16)7(17)8(18)5(2-14)22-12-11(21)10(20)9(19)6(3-15)23-12;/h2,4-13,15-21H,1,3H2;1H2/t4-,5+,6-,7-,8-,9-,10+,11-,12-;/m1./s1

IUPAC

(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

Product Data

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Format

Neat

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