Account sodium 3,4,5-trihydroxy-6-((13-methyl-17-oxo-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-3-yl)oxy)tetrahydro-2H-pyran-2-carboxylate
- Catalog No. :
- ACQZKG998
- CAS No. :
- 15087-01-1
- Molecular Formula :
- C24H29NaO8
- Molecular Weight :
- 468.48
IUPAC Name:sodium 3,4,5-trihydroxy-6-((13-methyl-17-oxo-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-3-yl)oxy)tetrahydro-2H-pyran-2-carboxylate
![sodium 3,4,5-trihydroxy-6-((13-methyl-17-oxo-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-3-yl)oxy)tetrahydro-2H-pyran-2-carboxylate structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | sodium 3,4,5-trihydroxy-6-((13-methyl-17-oxo-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-3-yl)oxy)tetrahydro-2H-pyran-2-carboxylate |
|---|---|
| IUPAC Name | sodium 3,4,5-trihydroxy-6-((13-methyl-17-oxo-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-3-yl)oxy)tetrahydro-2H-pyran-2-carboxylate |
| Molecular Formula | C24H29NaO8 |
| Molecular Weight | 468.48 |
| SMILES | CC12CCC3C4=CC=C(OC5OC(C(=O)[O-])C(O)C(O)C5O)C=C4CCC3C1CCC2=O.[Na+] |
| InChI Key | PBULYLQKWDXDFZ-UHFFFAOYSA-M |
| Synonym | ESTRONE-3-(BETA-D-GLUCURONIDE SODIUM SALT);ESTRONE-3-GLUCURONIDE SODIUM SALT;ESTRONE BETA-D-GLUCURONIDE SODIUM SALT;ESTRONE GLUCURONIDE, SODIUM SALT;3-HYDROXY-1,3,5[10]-ESTRATRIEN-17-ONE 3-GLUCURONIDE SODIUM SALT;1,3,5(10)-ESTRATRIEN-3-OL-17-ONE GLUCOSIDURONATE, SODIUM SALT;1,3,5[10]-ESTRATRIEN-3-OL-17-ONE 3-GLUCURONIDE SODIUM SALT;1,3,5(10)-ESTRATRIEN-3-OL-17-ONE 3(O->1BETA)-D-GLUCOPYRANOSIDURONIC ACID SODIUM SALT |
| CAS No. | 15087-01-1 |
Synthetic Route by SureRoute
2. ACQZKG998 Molecular Building Block Synthetic Route
(2S,3S,4S,5R,6S)-3,4,5-trihydroxy-6-(((8R,9S,13S,14S,17S)-17-hydroxy-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-3-yl)oxy)tetrahydro-2H-pyran-2-carboxylic acid
(2S,3S,4S,5R)-3,4,5-Trihydroxy-6-(4-(2-methylheptan-2-yl)phenoxy)tetrahydro-2H-pyran-2-carboxylic acid
(2S,3S,4S,5R,6R)-6-(((8R,9S,13S,14S,16R,17R)-3,17-dihydroxy-13-methyl-7,8,9,11,12,13,14,15,16,17-decahydro-6H-cyclopenta[a]phenanthren-16-yl)oxy)-3,4,5-trihydroxytetrahydro-2H-pyran-2-carboxylic acid