Lanceotoxin B
TL;DR: Lanceotoxin B (CAS 93802-98-3) is a chemical compound with molecular formula C32H44O11 and molecular weight 604.29 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[10-formyl-14-hydroxy-13-methyl-17-(6-oxopyran-3-yl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-5-yl] acetate
Also Known As: Lanceotoxin B, [10-formyl-14-hydroxy-13-methyl-17-(6-oxopyran-3-yl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-5-yl] acetate
| Molecular Formula | C32H44O11 |
|---|---|
| Molecular Weight | 604.29 g/mol |
| LogP | -0.1 |
| Topological Polar Surface Area | 169.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 6 |
| Exact Mass | 604.2884 |
| Heavy Atoms | 43 |
| Complexity | 1220.0 |
Chemical Identifiers
| CAS Number | 93802-98-3 |
|---|---|
| SMILES | CC1C(C(C(C(O1)OC2CCC3(C4CCC5(C(CCC5(C4CCC3(C2)OC(=O)C)O)C6=COC(=O)C=C6)C)C=O)O)O)O |
| InChIKey | IKNIMVNUBXHADS-UHFFFAOYSA-N |
Product Overview
Lanceotoxin B (CAS 93802-98-3), with molecular formula C32H44O11 and molecular weight 604.29 g/mol. IUPAC: [10-formyl-14-hydroxy-13-methyl-17-(6-oxopyran-3-yl)-3-(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-5-yl] acetate.
Chemical Property Profile of Lanceotoxin B
Property Insights of Lanceotoxin B
The XLogP value of -0.1 indicates that Lanceotoxin B is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 169.0 Ų indicates high polarity, suggesting Lanceotoxin B may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Lanceotoxin B has 4 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Lanceotoxin B?
The CAS number of Lanceotoxin B is 93802-98-3.
What is the molecular formula of Lanceotoxin B?
The molecular formula of Lanceotoxin B is C32H44O11.
What is the molecular weight of Lanceotoxin B?
The molecular weight of Lanceotoxin B is 604.29 g/mol.
Where can I buy Lanceotoxin B?
You can request a quote for Lanceotoxin B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Lanceotoxin B?
Yes, KEHONG BIO provides custom synthesis services for Lanceotoxin B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.