TL;DR: Astrachrysoside A (CAS 132160-35-1) is a chemical compound with molecular formula C41H68O13 and molecular weight 768.466 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,3R,4R,5R,6S)-2-[(2S,3R,4S,5R)-2-[[(9R,12S,14R,15R,16R)-9,14-dihydroxy-15-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-7,7,12,16-tetramethyl-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]oxy]-4,5-dihydroxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol
Also Known As: Astrachrysoside A, 3'-p-Hydroxy Paclitaxel, 3-O-(alpha-L-Rhamnopyranosyl-(1-2)-beta-D-xylopyranosyl)cycloastragenol, beta-D-Xylopyranoside, (3beta,6alpha,16beta,20R,24S)-20,24-epoxy-6,16,25-trihydroxy-9,19-cyclolanostan-3-yl 2-O-(6-deoxy-alpha-L-mannopyranosyl)-, (2S,3R,4R,5R,6S)-2-[(2S,3R,4S,5R)-2-[[(9R,12S,14R,15R,16R)-9,14-dihydroxy-15-[(2R,5S)-5-(2-hydroxypropan-2-yl)-2-methyloxolan-2-yl]-7,7,12,16-tetramethyl-6-pentacyclo[9.7.0.01,3.03,8.012,16]octadecanyl]oxy]-4,5-dihydroxyoxan-3-yl]oxy-6-methyloxane-3,4,5-triol
| Molecular Formula | C41H68O13 |
| Molecular Weight | 768.466 g/mol |
| XLogP | 1.8 |
| Topological Polar Surface Area (TPSA) | 208.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 6 |
| Exact Mass | 768.466 Da |
| Heavy Atoms | 54 |
| Complexity | 1440.0 |
| SMILES | C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@@H]2[C@H]([C@@H](CO[C@H]2OC3CCC45CC46CC[C@@]7([C@H]([C@@H](C[C@]7(C6C[C@H](C5C3(C)C)O)C)O)[C@]8(CC[C@H](O8)C(C)(C)O)C)C)O)O)O)O)O |
| InChIKey | LZRSXNSZMFQNOA-MUNPXEFMSA-N |
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Astrachrysoside A. The TPSA of 208.0 Ų indicates high polarity, suggesting Astrachrysoside A may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Astrachrysoside A has 8 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Astrachrysoside A is 132160-35-1.
The molecular formula of Astrachrysoside A is C41H68O13.
The molecular weight of Astrachrysoside A is 768.466 g/mol.
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