CAS 126223-28-7 - C42H70O12
TL;DR: CAS 126223-28-7 - C42H70O12 (CAS 126223-28-7) is a chemical compound with molecular formula C42H70O12 and molecular weight 766.48676 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,3R,4R,5R,6S)-2-[(2R,3R,4S,5S,6R)-2-[[(6R,10R,12S,13S,14R,17S)-4-ethyl-3,12-dihydroxy-4,10,14-trimethyl-17-(6-methylhepta-2,5-dien-2-yl)-1,2,3,5,6,7,8,9,11,12,13,15,16,17-tetradecahydrocyclopenta[a]phenanthren-6-yl]oxy]-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy-6-methyloxane-3,4,5-triol
Also Known As: (2S,3R,4R,5R,6S)-2-{[(2R,3R,4S,5S,6R)-2-{[(1S,3aR,5R,9aR,11S,11aS)-6-ethyl-7,11-dihydroxy-3a,6,9a-trimethyl-1-[(2Z)-6-methylhepta-2,5-dien-2-yl]-tetradecahydrocyclopenta[a]phenanthren-5-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]oxy}-6-methyloxane-3,4,5-triol
Technical Specifications
| Molecular Formula | C42H70O12 |
| Molecular Weight | 766.48676 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 199.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 9 |
| Exact Mass | 766.48676 Da |
| Heavy Atoms | 54 |
| Complexity | 1370.0 |
| SMILES | CCC1(C(CC[C@]2(C1[C@@H](CC3C2C[C@@H]([C@@H]4[C@@]3(CC[C@@H]4C(=CCC=C(C)C)C)C)O)O[C@H]5[C@@H]([C@H]([C@@H]([C@H](O5)CO)O)O)O[C@H]6[C@@H]([C@@H]([C@H]([C@@H](O6)C)O)O)O)C)O)C |
| InChIKey | YCTQSBSHNMQDKH-WMATXANUSA-N |
Chemical Property Profile of CAS 126223-28-7 - C42H70O12
Property Insights of CAS 126223-28-7 - C42H70O12
The XLogP value of 4.5 indicates that CAS 126223-28-7 - C42H70O12 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 199.0 Ų indicates high polarity, suggesting CAS 126223-28-7 - C42H70O12 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, CAS 126223-28-7 - C42H70O12 has 8 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of CAS 126223-28-7 - C42H70O12?
The CAS number of CAS 126223-28-7 - C42H70O12 is 126223-28-7.
What is the molecular formula of CAS 126223-28-7 - C42H70O12?
The molecular formula of CAS 126223-28-7 - C42H70O12 is C42H70O12.
What is the molecular weight of CAS 126223-28-7 - C42H70O12?
The molecular weight of CAS 126223-28-7 - C42H70O12 is 766.48676 g/mol.
Where can I buy CAS 126223-28-7 - C42H70O12?
You can request a quote for CAS 126223-28-7 - C42H70O12 directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for CAS 126223-28-7 - C42H70O12?
Yes, CoreyChem provides custom synthesis services for CAS 126223-28-7 - C42H70O12 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.