TL;DR: 10beta-Hydroxytaxa-4(20),11-dien-5alpha-yl acetate (CAS 337515-55-6) is a chemical compound with molecular formula C22H34O3 and molecular weight 346.2508 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(1S,3S,5S,8S,10S)-10-hydroxy-8,12,15,15-tetramethyl-4-methylidene-5-tricyclo[9.3.1.03,8]pentadec-11-enyl] acetate
Also Known As: 10beta-hydroxytaxa-4(20),11-dien-5alpha-yl acetate, Taxa-4(20),11(12)-dien-5alpha-acetoxy-10beta-ol, 5alpha-Acetoxytaxa-4(20),11(12)-dien-10beta-ol, J1.788.047K, 5alpha-Acetoxytaxa-4(20),11-diene-10beta-ol
| Molecular Formula | C22H34O3 |
| Molecular Weight | 346.2508 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 46.5 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 346.2508 Da |
| Heavy Atoms | 25 |
| Complexity | 615.0 |
| SMILES | CC1=C2[C@H](C[C@@]3(CC[C@@H](C(=C)[C@H]3C[C@@H](C2(C)C)CC1)OC(=O)C)C)O |
| InChIKey | BMPKIAPYMZISRD-PQTWGXLHSA-N |
The XLogP value of 3.7 indicates that 10beta-Hydroxytaxa-4(20),11-dien-5alpha-yl acetate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 46.5 Ų, 10beta-Hydroxytaxa-4(20),11-dien-5alpha-yl acetate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 10beta-Hydroxytaxa-4(20),11-dien-5alpha-yl acetate has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 10beta-Hydroxytaxa-4(20),11-dien-5alpha-yl acetate is 337515-55-6.
The molecular formula of 10beta-Hydroxytaxa-4(20),11-dien-5alpha-yl acetate is C22H34O3.
The molecular weight of 10beta-Hydroxytaxa-4(20),11-dien-5alpha-yl acetate is 346.2508 g/mol.
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