TL;DR: Glyyunnansapogenin A (CAS 131137-98-9) is a chemical compound with molecular formula C30H46O5 and molecular weight 486.33453 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4aS,6aR,6aS,6bR,9S,10S,12aR,14bR)-10-hydroxy-9-(hydroxymethyl)-2,4a,6a,6b,9,12a-hexamethyl-5-oxo-3,4,6,6a,7,8,8a,10,11,12,13,14b-dodecahydro-1H-picene-2-carboxylic acid
Also Known As: Glyyunnansapogenin A, 3,23-Dihydroxy-16-oxoolean-12-en-29-oic acid, (5xi)-3beta,24-Dihydroxy-16-oxo-18alpha-olean-12-en-29-oic acid, (4aS,6aR,6aS,6bR,9S,10S,12aR,14bR)-10-hydroxy-9-(hydroxymethyl)-2,4a,6a,6b,9,12a-hexamethyl-5-oxo-3,4,6,6a,7,8,8a,10,11,12,13,14b-dodecahydro-1H-picene-2-carboxylic acid
| Molecular Formula | C30H46O5 |
| Molecular Weight | 486.33453 g/mol |
| XLogP | 5.0 |
| Topological Polar Surface Area (TPSA) | 94.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 486.33453 Da |
| Heavy Atoms | 35 |
| Complexity | 987.0 |
| SMILES | C[C@]12CC[C@@H]([C@](C1CC[C@@]3([C@@H]2CC=C4[C@]3(CC(=O)[C@@]5([C@@H]4CC(CC5)(C)C(=O)O)C)C)C)(C)CO)O |
| InChIKey | JLSMRQKPAPRPMB-HUVORENVSA-N |
The XLogP value of 5.0 indicates that Glyyunnansapogenin A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 94.8 Ų falls within the moderate polarity range, balancing permeability and solubility for Glyyunnansapogenin A. Following Lipinski's Rule of Five, Glyyunnansapogenin A has 3 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Glyyunnansapogenin A is 131137-98-9.
The molecular formula of Glyyunnansapogenin A is C30H46O5.
The molecular weight of Glyyunnansapogenin A is 486.33453 g/mol.
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