136737-07-0
METHYL 4,5,7,8,9-PENTA-O-ACETYL-2,6-ANHYDRO-3-DEOXY-D-GLYCERO-D-GALACTO-NON-2-ENONATE
NameMETHYL 4,5,7,8,9-PENTA-O-ACETYL-2,6-ANHYDRO-3-DEOXY-D-GLYCERO-D-GALACTO-NON-2-ENONATE
1Identification
【Name】
METHYL 4,5,7,8,9-PENTA-O-ACETYL-2,6-ANHYDRO-3-DEOXY-D-GLYCERO-D-GALACTO-NON-2-ENONATE
【CAS】
【MDL】
MFCD07369536
【English Synonyms】
【Formula】
C20 H26 O13
【MolWeight】
474.412
【Inchi】
InChI=1S/C20H26O13/c1-9(21)28-8-16(30-11(3)23)18(32-13(5)25)19-17(31-12(4)24)14(29-10(2)22)7-15(33-19)20(26)27-6/h7,14,16-19H,8H2,1-6H3/t14-,16+,17+,18+,19+/m0/s1
【InChIKey】
InChIKey=PSLDDVLWELZUJX-AIHBUXEESA-N
【SMILES】
CC(=O)OC[C@H]([C@H]([C@H]1[C@@H]([C@H](C=C(O1)C(=O)OC)OC(=O)C)OC(=O)C)OC(=O)C)OC(=O)C
【MOL File】
METHYL 4,5,7,8,9-PEN….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:13
XLogP3:0.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
METHYL 4,5,7,8,9-PENTA-O-ACETYL-2,6-ANHYDRO-3-DEOXY-D-GLYCERO-D-GALACTO-NON-2-ENONATE.cml