A547115
(3beta)-Allopregnanolone 3-beta-D-Glucuronide
| Trivial name | (3beta)-Allopregnanolone 3-beta-D-Glucuronide |
| Catalog Number | TRC-A547115-100MG |
| Alternative Name(s) | (3β,5α)-20-Oxopregnan-3-yl β-D-Glucopyranosiduronic Acid; 20-Oxo-5α-pregnan-3β-yl β-D-Glucopyranosiduronic Acid; 20-Oxo-5α-pregnan-3β-yl Glucosiduronic Acid; 3β-Hydroxy-5α-pregnan-20-one Glucuronide; |
| Molecular Formula | C₂₇H₄₂O₈ |
| CAS# | 31300-87-5 |
| Inchi | InChI=1S/C27H42O8/c1-13(28)17-6-7-18-16-5-4-14-12-15(8-10-26(14,2)19(16)9-11-27(17,18)3)34-25-22(31)20(29)21(30)23(35-25)24(32)33/h14-23,25,29-31H,4-12H2,1-3H3,(H,32,33)/t14-,15-,16-,17+,18-,19-,20-,21-,22+,23-,25+,26-,27+/m0/s1 |
| SMILES | [H][C@@]12CC[C@@]3([H])C[C@@H](O[C@@H]4O[C@H](C(O)=O)[C@@H](O)[C@H](O)[C@H]4O)CC[C@]3(C)[C@@]1([H])CC[C@@]5(C)[C@@]2([H])CC[C@@H]5C(C)=O |
| Beilstein Registry Number | NA |
| Size | 100mg |
| Supplier Page | https://www.lgcstandards.com/CA/en/p/TRC-A547115-100MG |