Compound NP-005308
TL;DR: Compound NP-005308 (CAS 124727-10-2) is a chemical compound with molecular formula C42H66O14 and molecular weight 794.45 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1,2,6b,9,9,12a-hexamethyl-4a-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycarbonyl-10-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-6a-carboxylic acid
Also Known As: Compound NP-005308, MEGxp0_001400, ACon1_000677, B0005-162717, Quinovic acid 3-O-(6-deoxyglucoside) 28-O-glucosyl ester
| Molecular Formula | C42H66O14 |
|---|---|
| Molecular Weight | 794.45 g/mol |
| LogP | 2.2645 |
| Topological Polar Surface Area | 232.9 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 6 |
| Exact Mass | 794.44525 |
| Heavy Atoms | 56 |
| Complexity | 1550.279 |
Chemical Identifiers
| CAS Number | 124727-10-2 |
|---|---|
| SMILES | CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CCC(C5(C)C)OC6C(C(C(C(O6)C)O)O)O)C)C)C2C1C)C(=O)O)C(=O)OC7C(C(C(C(O7)CO)O)O)O |
Product Overview
Compound NP-005308 (CAS 124727-10-2), with molecular formula C42H66O14 and molecular weight 794.45 g/mol. IUPAC: 1,2,6b,9,9,12a-hexamethyl-4a-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxycarbonyl-10-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-2,3,4,5,6,6a,7,8,8a,10,11,12,13,14b-tetradecahydro-1H-picene-6a-carboxylic acid.
Chemical Property Profile of Compound NP-005308
Property Insights of Compound NP-005308
The XLogP value of 2.2645 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Compound NP-005308. The TPSA of 232.9 Ų indicates high polarity, suggesting Compound NP-005308 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Compound NP-005308 has 8 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Compound NP-005308?
The CAS number of Compound NP-005308 is 124727-10-2.
What is the molecular formula of Compound NP-005308?
The molecular formula of Compound NP-005308 is C42H66O14.
What is the molecular weight of Compound NP-005308?
The molecular weight of Compound NP-005308 is 794.45 g/mol.
Where can I buy Compound NP-005308?
You can request a quote for Compound NP-005308 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Compound NP-005308?
Yes, KEHONG BIO provides custom synthesis services for Compound NP-005308 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.