TL;DR: FR 901512 (CAS 151606-25-6) is a chemical compound with molecular formula C21H28O6 and molecular weight 376.1886 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-7-(8-acetyloxy-2,6-dimethyl-5,6,7,8-tetrahydronaphthalen-1-yl)-3,5-dihydroxyhept-6-enoic acid
Also Known As: FR 901512, J2.041.947D, (E)-7-(8-acetyloxy-2,6-dimethyl-5,6,7,8-tetrahydronaphthalen-1-yl)-3,5-dihydroxy-hept-6-enoic Acid, (E)-7-(8-acetyloxy-2,6-dimethyl-5,6,7,8-tetrahydronaphthalen-1-yl)-3,5-dihydroxyhept-6-enoic acid, 6-Heptenoic acid, 7-[(6R,8S)-8-(acetyloxy)-5,6,7,8-tetrahydro-2,6-dimethyl-1-naphthalenyl]-3,5-dihydroxy-, (3R,5S,6E)-
| Molecular Formula | C21H28O6 |
| Molecular Weight | 376.1886 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 104.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 8 |
| Exact Mass | 376.1886 Da |
| Heavy Atoms | 27 |
| Complexity | 545.0 |
| SMILES | CC1CC(C2=C(C1)C=CC(=C2/C=C/C(CC(CC(=O)O)O)O)C)OC(=O)C |
| InChIKey | CFHKAMNUJQAFGO-VOTSOKGWSA-N |
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for FR 901512. The TPSA of 104.0 Ų falls within the moderate polarity range, balancing permeability and solubility for FR 901512. Following Lipinski's Rule of Five, FR 901512 has 3 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of FR 901512 is 151606-25-6.
The molecular formula of FR 901512 is C21H28O6.
The molecular weight of FR 901512 is 376.1886 g/mol.
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