1-O-(fucopyranosyl-(4'-sulfate))-5-spirostane-1,3-diol
TL;DR: 1-O-(fucopyranosyl-(4'-sulfate))-5-spirostane-1,3-diol (CAS 151589-15-0) is a chemical compound with molecular formula C33H54O11S and molecular weight 658.3387 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(2S,3S,4S,5S,6S)-4,5-dihydroxy-6-[(1S,2S,5'S,7S,8R,9S,12S,13S,14R,16R,18S)-16-hydroxy-5',7,9,13-tetramethylspiro[5-oxapentacyclo[10.8.0.02,9.04,8.013,18]icosane-6,2'-oxane]-14-yl]oxy-2-methyloxan-3-yl] hydrogen sulfate
Also Known As: 1-O-Fucso4-ssd, Brisbagenin fucoside-4-(hydrogen sulfate), 1-O-(Fucopyranosyl-(4'-sulfate))-5-spirostane-1,3-diol, 3-Hydroxyspirostan-1-yl 6-deoxy-4-O-sulfohexopyranoside, 1-O-(fucopyranosyl-(4/'-sulfate))-5-spirostane-1,3-diol
Technical Specifications
| Molecular Formula | C33H54O11S |
| Molecular Weight | 658.3387 g/mol |
| XLogP | 4.0 |
| Topological Polar Surface Area (TPSA) | 170.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 4 |
| Exact Mass | 658.3387 Da |
| Heavy Atoms | 45 |
| Complexity | 1230.0 |
| SMILES | C[C@H]1CCC2([C@H]([C@H]3C(O2)C[C@@H]4[C@@]3(CC[C@H]5[C@H]4CC[C@@H]6[C@@]5([C@@H](C[C@@H](C6)O)O[C@@H]7[C@H]([C@@H]([C@@H]([C@@H](O7)C)OS(=O)(=O)O)O)O)C)C)C)OC1 |
| InChIKey | VEBWDEUHONOFKN-BEPJGEAPSA-N |
Chemical Property Profile of 1-O-(fucopyranosyl-(4'-sulfate))-5-spirostane-1,3-diol
Property Insights of 1-O-(fucopyranosyl-(4'-sulfate))-5-spirostane-1,3-diol
The XLogP value of 4.0 indicates that 1-O-(fucopyranosyl-(4'-sulfate))-5-spirostane-1,3-diol is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 170.0 Ų indicates high polarity, suggesting 1-O-(fucopyranosyl-(4'-sulfate))-5-spirostane-1,3-diol may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 1-O-(fucopyranosyl-(4'-sulfate))-5-spirostane-1,3-diol has 4 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of 1-O-(fucopyranosyl-(4'-sulfate))-5-spirostane-1,3-diol?
The CAS number of 1-O-(fucopyranosyl-(4'-sulfate))-5-spirostane-1,3-diol is 151589-15-0.
What is the molecular formula of 1-O-(fucopyranosyl-(4'-sulfate))-5-spirostane-1,3-diol?
The molecular formula of 1-O-(fucopyranosyl-(4'-sulfate))-5-spirostane-1,3-diol is C33H54O11S.
What is the molecular weight of 1-O-(fucopyranosyl-(4'-sulfate))-5-spirostane-1,3-diol?
The molecular weight of 1-O-(fucopyranosyl-(4'-sulfate))-5-spirostane-1,3-diol is 658.3387 g/mol.
Where can I buy 1-O-(fucopyranosyl-(4'-sulfate))-5-spirostane-1,3-diol?
You can request a quote for 1-O-(fucopyranosyl-(4'-sulfate))-5-spirostane-1,3-diol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-O-(fucopyranosyl-(4'-sulfate))-5-spirostane-1,3-diol?
Yes, CoreyChem provides custom synthesis services for 1-O-(fucopyranosyl-(4'-sulfate))-5-spirostane-1,3-diol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.