分析物名称

4-Hydroxyestradiol 3-O-beta-D-Glucuronide

CAS登记号

90746-94-4

分子式

C24H32O9

分子量

464.51

精确质量测定

464.2046

SMILES

C[C@]12CC[C@H]3[C@@H](CCc4c(O)c(O[C@@H]5O[C@@H]([C@@H](O)[C@H](O)[C@H]5O)C(=O)O)ccc34)[C@@H]1CC[C@@H]2O

InChI

InChI=1S/C24H32O9/c1-24-9-8-11-10-4-6-15(32-23-20(29)18(27)19(28)21(33-23)22(30)31)17(26)13(10)3-2-12(11)14(24)5-7-16(24)25/h4,6,11-12,14,16,18-21,23,25-29H,2-3,5,7-9H2,1H3,(H,30,31)/t11-,12-,14+,16+,18+,19+,20-,21+,23-,24+/m1/s1

IUPAC

(2S,3S,4S,5R,6S)-6-[[(8R,9S,13S,14S,17S)-4,17-dihydroxy-13-methyl-6,7,8,9,11,12,14,15,16,17-decahydrocyclopenta[a]phenanthren-3-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid

运输温度

Room Temperature

原产国

CANADA

产品类型

Bioactive Small Molecule

产品形式

Neat