Analyte Name

L-threo-L-ido-undeodialdo-1,5:11,7-dipyranoside,1,11-Dimethyl 1,11-bis-C-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-7-C-formyl-,(5E,6E,7E,11S)

CAS Number

1528739-05-0

Molecular Formula

C44 H50 Cl2 O14

Molecular Weight

873.765

Accurate Mass

872.258

SMILES

CCOc1ccc(Cc2cc(ccc2Cl)[C@]3(OC)OC(C(O)C4(O[C@](OC)([C@H](O)[C@@H](O)[C@@H]4O)c5ccc(Cl)c(Cc6ccc(OCC)cc6)c5)C=O)[C@@H](O)[C@H](O)[C@H]3O)cc1

InChI

InChI=1S/C44H50Cl2O14/c1-5-57-30-13-7-24(8-14-30)19-26-21-28(11-17-32(26)45)43(55-3)39(52)35(49)34(48)37(59-43)41(54)42(23-47)38(51)36(50)40(53)44(56-4,60-42)29-12-18-33(46)27(22-29)20-25-9-15-31(16-10-25)58-6-2/h7-18,21-23,34-41,48-54H,5-6,19-20H2,1-4H3/t34-,35-,36-,37?,38-,39+,40+,41?,42?,43-,44-/m0/s1

IUPAC

(3S,4S,5R,6S)-6-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-2-[[(3S,4S,5R,6S)-6-[4-chloro-3-[(4-ethoxyphenyl)methyl]phenyl]-3,4,5-trihydroxy-6-methoxyoxan-2-yl]-hydroxymethyl]-3,4,5-trihydroxy-6-methoxyoxane-2-carbaldehyde

Shipping Temperature

Room Temperature

Country of Origin

CANADA

Product Type

Impurity

Product Format

Neat