58365-86-9
METHYL-2-O-BENZOYL-3,5-O-ISOPROPYLIDENE-D-XYLOFURANOSIDE
NameMETHYL-2-O-BENZOYL-3,5-O-ISOPROPYLIDENE-D-XYLOFURANOSIDE
1Identification
【Name】
METHYL-2-O-BENZOYL-3,5-O-ISOPROPYLIDENE-D-XYLOFURANOSIDE
【CAS】
【MDL】
MFCD08689847
【English Synonyms】
【Formula】
C16 H20 O6
【MolWeight】
308.328
【Inchi】
InChI=1S/C16H20O6/c1-16(2)19-9-11-12(22-16)13(15(18-3)20-11)21-14(17)10-7-5-4-6-8-10/h4-8,11-13,15H,9H2,1-3H3/t11-,12+,13-,15?/m1/s1
【InChIKey】
InChIKey=YGSMVOHGILASOG-WORDMNGFSA-N
【SMILES】
CC1(OC[C@@H]2[C@H](O1)[C@H](C(O2)OC)OC(=O)c3ccccc3)C
【MOL File】
METHYL-2-O-BENZOYL-3….mol
2Chemical and Physical Properties
【Computed Properties】
H bond donor:0
H bond acceptor:6
XLogP3:1.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
METHYL-2-O-BENZOYL-3,5-O-ISOPROPYLIDENE-D-XYLOFURANOSIDE.cml