57236-72-3
1-O-ACETYL-2-DEOXY-3,5-DI-O-(4-METHYLBENZOYL)-BETA-D-ERYTHROPENTOFURANOSE
Name1-O-ACETYL-2-DEOXY-3,5-DI-O-(4-METHYLBENZOYL)-BETA-D-ERYTHROPENTOFURANOSE
1Identification
【Name】
1-O-ACETYL-2-DEOXY-3,5-DI-O-(4-METHYLBENZOYL)-BETA-D-ERYTHROPENTOFURANOSE
【CAS】
【MDL】
MFCD08703985
【中文同义词】
【EnglishSynonyms】
【pro_formula】
C23 H24 O7
【pro_molWeight】
412.436
【Inchi】
InChI=1S/C23H24O7/c1-14-4-8-17(9-5-14)22(25)27-13-20-19(12-21(29-20)28-16(3)24)30-23(26)18-10-6-15(2)7-11-18/h4-11,19-21H,12-13H2,1-3H3/t19-,20+,21+/m0/s1
【InChIKey】
InChIKey=AEEIKTDMFUOGDM-PWRODBHTSA-N
【SMILES】
Cc1ccc(cc1)C(=O)OC[C@@H]2[C@H](C[C@@H](O2)OC(=O)C)OC(=O)c3ccc(cc3)C
【MOL File】
1-O-ACETYL-2-DEOXY-3….mol
2ChemicalProperties
【ComputedProperties】
pro_donors:0
pro_acceptors:7
XLogP3:3.0
Bulk/Fine:F
3MaterialMSDS
4CMLFile
1-O-ACETYL-2-DEOXY-3,5-DI-O-(4-METHYLBENZOYL)-BETA-D-ERYTHROPENTOFURANOSE.cml