| CAS Number | 15087-06-6 |
| Catalog Number | AG001MWF(AGN-PC-00URMB) |
| Chemical Name | β-D-Glucopyranosiduronic acid, (16α,17β)-16,17-dihydroxyestra-1,3,5(10)-trien-3-yl, sodium salt (1:1) |
| IUPAC Name | 6-[(16,17-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;sodium |
| InChI | InChI=1S/C24H32O9.Na/c1-24-7-6-13-12-5-3-11(32-23-19(28)17(26)18(27)20(33-23)22(30)31)8-10(12)2-4-14(13)15(24)9-16(25)21(24)29;/h3,5,8,13-21,23,25-29H,2,4,6-7,9H2,1H3,(H,30,31); |
| InChI Key | OMEVKFHIFIXRHB-UHFFFAOYSA-N |
| MDL Number | MFCD00056545 |
| Molecular Formula | C24H32NaO9 |
| Molecular Weight | 487.4953 |
| SMILES | C[C@@]12[C@]([C@]3([C@@](C=4C(CC3)=CC(O[C@@H]5O[C@H](C(O)=O)[C@@H](O)[C@H](O)[C@H]5O)=CC4)(CC1)[H])[H])(C[C@@H](O)[C@@H]2O)[H].[Na] |
| Synonyms | Estriol 3-(beta-D-glucuronide) sodium salt,
15087-06-6,
CTK8F9502,
DTXSID40585144,
PUBCHEM_16219307,
AKOS030255404,
Estriol 3-(|A-D-glucuronide) sodium salt,
Estriol 3-( -D-glucuronide) sodium salt,
FT-0764291,
1,3,5(10)-Estratriene-3,16|A,17|A-triol 3-glucuronide,
3,16|A,17|A-Trihydroxy-1,3,5(10)-estratriene 3-glucuronide,
|