分析物名称

6'-Hydroxy Delavirdine O-beta-D-Glucuronide

CAS登记号

188780-39-4

分子式

C28H36N6O10S

分子量

648.68

精确质量测定

648.22

SMILES

O=S(NC1=CC=C(NC(C(N2CCN(C3=NC(O[C@H]4[C@H](O)[C@@H](O)[C@H](O)[C@@H](C(O)=O)O4)=CC=C3NC(C)C)CC2)=O)=C5)C5=C1)(C)=O

InChI

InChI=1S/C28H36N6O10S/c1-14(2)29-18-6-7-20(43-28-23(37)21(35)22(36)24(44-28)27(39)40)31-25(18)33-8-10-34(11-9-33)26(38)19-13-15-12-16(32-45(3,41)42)4-5-17(15)30-19/h4-7,12-14,21-24,28-30,32,35-37H,8-11H2,1-3H3,(H,39,40)/t21-,22-,23+,24?,28+/m0/s1

IUPAC

(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-((5-(isopropylamino)-6-(4-(5-(methylsulfonamido)-1H-indole-2-carbonyl)piperazin-1-yl)pyridin-2-yl)oxy)tetrahydro-2H-pyran-2-carboxylic acid

运输温度

Room Temperature

原产国

CANADA

产品形式

Neat