Uralsaponin B
TL;DR: Uralsaponin B (CAS 114838-67-4) is a chemical compound with molecular formula C42H62O16 and molecular weight 822.4038 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-[2-carboxy-6-[(11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl)oxy]-3,5-dihydroxyoxan-4-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
Also Known As: Uralsaponin B, Minamestane, 6-[2-carboxy-6-[(11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-2,3,4a,5,6,7,8,9,10,12,12a,14a-dodecahydro-1H-picen-3-yl)oxy]-3,5-dihydroxyoxan-4-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid, 29-hydroxy-11,29-dioxoolean-12-en-3-yl 3-o-hexopyranuronosylhexopyranosiduronic acid, 3 Hydroxy-11-oxoolean-12-en-30-oic acid-3-O-glucuronopyranosyl-(1-3)glucuronopyranoside
Technical Specifications
| Molecular Formula | C42H62O16 |
| Molecular Weight | 822.4038 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 267.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 16 |
| Rotatable Bonds | 7 |
| Exact Mass | 822.4038 Da |
| Heavy Atoms | 58 |
| Complexity | 1730.0 |
| SMILES | CC1(C2CCC3(C(C2(CCC1OC4C(C(C(C(O4)C(=O)O)O)OC5C(C(C(C(O5)C(=O)O)O)O)O)O)C)C(=O)C=C6C3(CCC7(C6CC(CC7)(C)C(=O)O)C)C)C)C |
| InChIKey | KEIFOIQHFNUSQE-UHFFFAOYSA-N |
Chemical Property Profile of Uralsaponin B
Property Insights of Uralsaponin B
The XLogP value of 3.7 indicates that Uralsaponin B is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 267.0 Ų indicates high polarity, suggesting Uralsaponin B may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Uralsaponin B has 8 hydrogen bond donor(s) and 16 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Uralsaponin B?
The CAS number of Uralsaponin B is 114838-67-4.
What is the molecular formula of Uralsaponin B?
The molecular formula of Uralsaponin B is C42H62O16.
What is the molecular weight of Uralsaponin B?
The molecular weight of Uralsaponin B is 822.4038 g/mol.
Where can I buy Uralsaponin B?
You can request a quote for Uralsaponin B directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Uralsaponin B?
Yes, CoreyChem provides custom synthesis services for Uralsaponin B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.