1-(5-脱氧-5-{[4-羟基-4-(5-羟基吡啶-2-基)缬氨酰]氨基}六呋喃糖醛糖基)-2-羰基-2,3-二氢-1H-咪唑-4-羧酸

74261-09-9

MFCD01746052

C21 H29 O5 S . K . H2 O

450.634

InChI=1S/C21H30O5S.K.H2O/c1-5-6-7-8-15-12-18-20(19(13-15)26-27(22,23)24)16-11-14(2)9-10-17(16)21(3,4)25-18;;/h9,12-13,16-17H,5-8,10-11H2,1-4H3,(H,22,23,24);;1H2/q;+1;/p-1/t16-,17-;;/m1../s1

InChIKey=FEQUESQWPJKYRN-QAPNYFPESA-M

CCCCCc1cc2c(c(c1)OS(=O)(=O)[O-])[C@@H]3CC(=CC[C@H]3C(O2)(C)C)C.O.[K+]

pro_donors:0

pro_acceptors:5

XLogP3:5.0

Bulk/Fine:F