Catalog Number:
AG002KQJ
Chemical Name:
2H-1-Benzopyran-2-one, 7-[[2-(acetylamino)-2-deoxy-3-O-β-D-galactopyranosyl-α-D-galactopyranosyl]oxy]-4-methyl-
CAS Number:
210357-36-1
Molecular Formula:
C24H31NO13
Molecular Weight:
541.5018
MDL Number:
MFCD00270048
IUPAC Name:
N-[(2R,3R,4R,5R,6R)-5-hydroxy-6-(hydroxymethyl)-2-(4-methyl-2-oxochromen-7-yl)oxy-4-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-3-yl]acetamide
InChI:
InChI=1S/C24H31NO13/c1-9-5-16(29)35-13-6-11(3-4-12(9)13)34-23-17(25-10(2)28)22(19(31)15(8-27)36-23)38-24-21(33)20(32)18(30)14(7-26)37-24/h3-6,14-15,17-24,26-27,30-33H,7-8H2,1-2H3,(H,25,28)/t14-,15-,17-,18+,19+,20+,21-,22-,23+,24+/m1/s1
InChI Key:
VSWQTQWBDDXHMJ-IJHJDGDSSA-N
SMILES:
OC[C@H]1O[C@H](Oc2ccc3c(c2)oc(=O)cc3C)[C@@H]([C@H]([C@H]1O)O[C@@H]1O[C@H](CO)[C@@H]([C@@H]([C@H]1O)O)O)NC(=O)C
