V6Pxe6SA7G
TL;DR: V6Pxe6SA7G (CAS 101694-19-3) is a chemical compound with molecular formula C39H36O14 and molecular weight 728.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[[(2R,3aS,4R,6S,7R,7aS)-7-[(2R,3R,4S,5S,6R)-3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methyl-2-phenyl-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-6-yl]oxy]-8-hydroxy-15-methyl-11,18-dioxapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,8,12(20),13,15-octaene-10,17-dione
Also Known As: A-132, 10-[[3-O,4-O-[(R)-Benzylidene]-6-deoxy-2-O-(6-deoxy-3-O-methyl-alpha-D-galactopyranosyl)-beta-D-galactopyranosyl]oxy]-6-hydroxy-1-methylbenzo[h][1]benzopyrano[5,4,3-cde][1]benzopyran-5,12-dione, 10-[[6-Deoxy-2-O-(6-deoxy-3-O-methyl-alpha-D-galactopyranosyl)-3,4-O-[(R)-phenylmethylene]-beta-D-galactopyranosyl]oxy]-6-hydroxy-1-methylbenzo[h][1]benzopyrano[5,4,3-cde][1]benzopyran-5,12-dione, 3-{[(2R,3aS,4R,6S,7R,7aS)-7-{[(2R,3R,4S,5S,6R)-3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl]oxy}-4-methyl-2-phenyl-hexahydro-[1,3]dioxolo[4,5-c]pyran-6-yl]oxy}-8-hydroxy-15-methyl-11,18-dioxapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2,4,6,8,12(20),13,15-octaene-10,17-dione, Benzo[h][1]benzopyrano[5,4,3-cde][1]benzopyran-5,12-dione, 10-[[6-deoxy-2-O-(6-deoxy-3-O-methyl-alpha-D-galactopyranosyl)-3,4-O-[(R)-phenylmethylene]-beta-D-galactopyranosyl]oxy]-6-hydroxy-1-methyl-
| Molecular Formula | C39H36O14 |
|---|---|
| Molecular Weight | 728.21 g/mol |
| LogP | 4.13082 |
| Topological Polar Surface Area | 185.72 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 6 |
| Exact Mass | 728.2105 |
| Heavy Atoms | 53 |
| Complexity | 2459.4194 |
Chemical Identifiers
| CAS Number | 101694-19-3 |
|---|---|
| SMILES | C[C@@H]1[C@@H]([C@@H]([C@H]([C@H](O1)O[C@@H]2[C@@H]3[C@H]([C@H](O[C@H]2OC4=CC=CC5=C4C6=C7C8=C(C=CC(=C8C(=O)O6)C)OC(=O)C7=C5O)C)O[C@H](O3)C9=CC=CC=C9)O)OC)O |
Product Overview
V6Pxe6SA7G (CAS 101694-19-3), with molecular formula C39H36O14 and molecular weight 728.21 g/mol. IUPAC: 3-[[(2R,3aS,4R,6S,7R,7aS)-7-[(2R,3R,4S,5S,6R)-3,5-dihydroxy-4-methoxy-6-methyloxan-2-yl]oxy-4-methyl-2-phenyl-4,6,7,7a-tetrahydro-3aH-[1,3]dioxolo[4,5-c]pyran-6-yl]oxy]-8-hydroxy-15-methyl-11,18-dioxapentacyclo[10.6.2.02,7.09,19.016,20]icosa-1(19),2(7),3,5,8,12(20),13,15-octaene-10,17-dione.
Chemical Property Profile of V6Pxe6SA7G
Property Insights of V6Pxe6SA7G
The XLogP value of 4.13082 indicates that V6Pxe6SA7G is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 185.72 Ų indicates high polarity, suggesting V6Pxe6SA7G may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, V6Pxe6SA7G has 3 hydrogen bond donor(s) and 14 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of V6Pxe6SA7G?
The CAS number of V6Pxe6SA7G is 101694-19-3.
What is the molecular formula of V6Pxe6SA7G?
The molecular formula of V6Pxe6SA7G is C39H36O14.
What is the molecular weight of V6Pxe6SA7G?
The molecular weight of V6Pxe6SA7G is 728.21 g/mol.
Where can I buy V6Pxe6SA7G?
You can request a quote for V6Pxe6SA7G directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for V6Pxe6SA7G?
Yes, KEHONG BIO provides custom synthesis services for V6Pxe6SA7G and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.