TL;DR: Picrasinoside H (CAS 135638-54-9) is a chemical compound with molecular formula C30H44O13 and molecular weight 612.2782 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[17-methoxy-7,15,19,20-tetramethyl-18-oxo-10-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,5,11-trioxapentacyclo[10.7.1.02,6.08,20.014,19]icos-16-en-7-yl] acetate
Also Known As: Picrasinoside H, [17-Methoxy-7,15,19,20-tetramethyl-18-oxo-10-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,5,11-trioxapentacyclo[10.7.1.02,6.08,20.014,19]icos-16-en-7-yl] acetate, 6-(Hexopyranosyloxy)-11-methoxy-4,7b,9,12a-tetramethyl-12-oxo-3a,4,4a,5,6,7a,7b,8,8a,9,12,12a,12b,12c-tetradecahydro-2H-[1,3]dioxolo[3,4]phenanthro[10,1-bc]pyran-4-yl acetate, Picras-2-en-1-one, 13-(acetyloxy)-16-(beta-D-glucopyranosyloxy)-2-methoxy-11,12-(methylenebis(oxy))-, (11alpha,12beta,16alpha)-
| Molecular Formula | C30H44O13 |
| Molecular Weight | 612.2782 g/mol |
| XLogP | 0.6 |
| Topological Polar Surface Area (TPSA) | 180.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 6 |
| Exact Mass | 612.2782 Da |
| Heavy Atoms | 43 |
| Complexity | 1160.0 |
| SMILES | CC1C=C(C(=O)C2(C1CC3C4(C2C5C(C(C4CC(O3)OC6C(C(C(C(O6)CO)O)O)O)(C)OC(=O)C)OCO5)C)C)OC |
| InChIKey | NLABKWWGROHMBZ-UHFFFAOYSA-N |
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Picrasinoside H. The TPSA of 180.0 Ų indicates high polarity, suggesting Picrasinoside H may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Picrasinoside H has 4 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
The CAS number of Picrasinoside H is 135638-54-9.
The molecular formula of Picrasinoside H is C30H44O13.
The molecular weight of Picrasinoside H is 612.2782 g/mol.
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