Catalog Number:
AG003W6I
Chemical Name:
(3S,4R)-Methyl 3-(4-chlorobenzoyl)-6-(4-chlorophenyl)-3,4,5-trihydroxy-6-oxohexanoate
CAS Number:
99886-53-0
Molecular Formula:
C20H18Cl2O7
Molecular Weight:
441.2587
MDL Number:
MFCD12197317
IUPAC Name:
methyl (3S,4R)-3-(4-chlorobenzoyl)-6-(4-chlorophenyl)-3,4,5-trihydroxy-6-oxohexanoate
InChI:
InChI=1S/C20H18Cl2O7/c1-29-15(23)10-20(28,18(26)12-4-8-14(22)9-5-12)19(27)17(25)16(24)11-2-6-13(21)7-3-11/h2-9,17,19,25,27-28H,10H2,1H3/t17?,19-,20-/m1/s1
InChI Key:
XYRDGHQDDWNESS-IPNZSQQUSA-N
SMILES:
COC(=O)C[C@@](C(=O)c1ccc(cc1)Cl)([C@@H](C(C(=O)c1ccc(cc1)Cl)O)O)O
