Bovosidol A
TL;DR: Bovosidol A (CAS 468-13-3) is a chemical compound with molecular formula C31H46O9 and molecular weight 562.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-[(3S,5R,10R,13R,14S,17R)-3-[(2R,5R)-3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl]oxy-14-hydroxy-10-(hydroxymethyl)-13-methyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pyran-2-one
Also Known As: Bovosidol A, KST-1A5069, 4-18-00-02558 (Beilstein Handbook Reference), (3, A,5
| Molecular Formula | C31H46O9 |
|---|---|
| Molecular Weight | 562.31 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 135.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 562.3142 |
| Heavy Atoms | 40 |
| Complexity | 1040.0 |
Chemical Identifiers
| CAS Number | 468-13-3 |
|---|---|
| SMILES | CC1[C@H](C(C([C@@H](O1)O[C@H]2CC[C@]3([C@@H](C2)CCC4C3CC[C@]5([C@@]4(CC[C@@H]5C6=COC(=O)C=C6)O)C)CO)O)OC)O |
| InChIKey | OXBRMYXRHPWEIC-MXGRDHLTSA-N |
Product Overview
Bovosidol A (CAS 468-13-3), with molecular formula C31H46O9 and molecular weight 562.31 g/mol. IUPAC: 5-[(3S,5R,10R,13R,14S,17R)-3-[(2R,5R)-3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl]oxy-14-hydroxy-10-(hydroxymethyl)-13-methyl-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pyran-2-one.
Chemical Property Profile of Bovosidol A
Property Insights of Bovosidol A
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bovosidol A. The TPSA of 135.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Bovosidol A. Following Lipinski's Rule of Five, Bovosidol A has 4 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bovosidol A?
The CAS number of Bovosidol A is 468-13-3.
What is the molecular formula of Bovosidol A?
The molecular formula of Bovosidol A is C31H46O9.
What is the molecular weight of Bovosidol A?
The molecular weight of Bovosidol A is 562.31 g/mol.
Where can I buy Bovosidol A?
You can request a quote for Bovosidol A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bovosidol A?
Yes, KEHONG BIO provides custom synthesis services for Bovosidol A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.