| Identification | |
| Name: | D-glycero-D-galacto-Non-2-enonicacid, 5-(acetylamino)-2,6-anhydro-4-azido-3,4,5-trideoxy-, methyl ester,7,8,9-triacetate |
| Synonyms: | D-GLYCERO-D-GALACTO-NON-2-ENONIC ACID;5-(acetylamino)-2,6-anhydro-4-azido-3,4,5-trideoxy-,methyl ester, 7,8,9-triacetate |
| CAS: | 130525-58-5 |
| Molecular Formula: | C18H24 N4 O10 |
| Molecular Weight: | 0 |
| InChI: | InChI=1/C18H24N4O10/c1-8(23)20-15-12(21-22-19)6-13(18(27)28-5)32-17(15)16(31-11(4)26)14(30-10(3)25)7-29-9(2)24/h6,12,14-17H,7H2,1-5H3,(H,20,23)/t12-,14+,15+,16+,17+/m0/s1 |
| Molecular Structure: |  |
| Properties | |
| Appearance: | Off-white solid |
| Specification: |
The Methyl 5-acetamido-7,8,9-O-triacetyl-2,6-anhydro-4-azido-3,4,5-trideoxy-D-glycero-D-galacto-non-2-enonate, with the CAS registry number 130525-58-5, has the systematic name of methyl 7,8,9-tri-O-acetyl-5-(acetylamino)-2,6-anhydro-4-azido-3,4,5-trideoxy-D-glycero-D-galacto-non-2-enonate. And the molecular formula of the chemical is C18H24N4O10. The characteristics of this chemical are as followings: (1)ACD/LogP: 0.74; (2)# of Rule of 5 Violations: 1; (3)ACD/LogD (pH 5.5): -1; (4)ACD/LogD (pH 7.4): -1; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 12; (8)ACD/KOC (pH 7.4): 12; (9)#H bond acceptors: 14; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 13; (12)Polar Surface Area: 155.89 Å2. Addtionally, the following datas could be converted into the molecular structure: |
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