Triploside C
TL;DR: Triploside C (CAS 141544-42-5) is a chemical compound with molecular formula C52H84O19 and molecular weight 1012.56067 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4aS,6aR,6aS,6bR,10S,12aR,14bR)-10-[(2S,3R,4S,5S)-3,5-bis[[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy]-4-[(2R,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid
Also Known As: Triploside C, (4aS,6aR,6aS,6bR,10S,12aR,14bR)-10-[(2S,3R,4S,5S)-3,5-bis[[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy]-4-[(2R,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydropicene-4a-carboxylic acid, Oleanolic acid 3-O-alpha-L-rhamnopyranosyl(1-3)-beta-D-xylopyranosyl(1-3)-alpha-L-rhamnopyranosyl(1-2)-alpha-L-arabinopyranoside, (4aS,6aR,6aS,6bR,10S,12aR,14bR)-10-[(2S,3R,4S,5S)-3,5-bis[[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy]-4-[(2R,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyoxan-2-yl]oxy-2,2,6a,6b,9,9,12a-heptamethyl-1,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydr
Technical Specifications
| Molecular Formula | C52H84O19 |
| Molecular Weight | 1012.56067 g/mol |
| XLogP | 2.2 |
| Topological Polar Surface Area (TPSA) | 293.0 Ų |
| Hydrogen Bond Donors | 10 |
| Hydrogen Bond Acceptors | 19 |
| Rotatable Bonds | 9 |
| Exact Mass | 1012.56067 Da |
| Heavy Atoms | 71 |
| Complexity | 1970.0 |
| SMILES | C[C@H]1[C@@H]([C@H]([C@H]([C@@H](O1)O[C@H]2CO[C@H]([C@@H]([C@H]2O[C@@H]3[C@@H]([C@H]([C@@H](CO3)O)O)O)O[C@H]4[C@@H]([C@@H]([C@H]([C@@H](O4)C)O)O)O)O[C@H]5CC[C@@]6([C@H]7CC=C8[C@H]9CC(CC[C@@]9(CC[C@]8([C@@]7(CCC6C5(C)C)C)C)C(=O)O)(C)C)C)O)O)O |
| InChIKey | XAFDYNYZRDQZAF-KVACYZFBSA-N |
Chemical Property Profile of Triploside C
Property Insights of Triploside C
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Triploside C. The TPSA of 293.0 Ų indicates high polarity, suggesting Triploside C may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Triploside C has 10 hydrogen bond donor(s) and 19 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Triploside C?
The CAS number of Triploside C is 141544-42-5.
What is the molecular formula of Triploside C?
The molecular formula of Triploside C is C52H84O19.
What is the molecular weight of Triploside C?
The molecular weight of Triploside C is 1012.56067 g/mol.
Where can I buy Triploside C?
You can request a quote for Triploside C directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Triploside C?
Yes, CoreyChem provides custom synthesis services for Triploside C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.