杠柳心苷
TL;DR: 杠柳心苷 (CAS 32476-67-8) is a chemical compound with molecular formula C30H46O8 and molecular weight 534.32 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
杠柳心苷
3-[5,14-dihydroxy-3-(5-hydroxy-4-methoxy-6-methyloxan-2-yl)oxy-10,13-dimethyl-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2H-furan-5-one
Also Known As: Periplocymarin, Vanderosid, Vanderoside, Periplocymarin [M+H]+, Periplogenin + D-cymarose
| Molecular Formula | C30H46O8 |
|---|---|
| Molecular Weight | 534.32 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 115.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 534.3193 |
| Heavy Atoms | 38 |
| Complexity | 983.0 |
Chemical Identifiers
| CAS Number | 32476-67-8 |
|---|---|
| SMILES | CC1C(C(CC(O1)OC2CCC3(C4CCC5(C(CCC5(C4CCC3(C2)O)O)C6=CC(=O)OC6)C)C)OC)O |
| InChIKey | XRWQBDJPMXRDOQ-UHFFFAOYSA-N |
Product Overview
杠柳心苷 (CAS 32476-67-8), with molecular formula C30H46O8 and molecular weight 534.32 g/mol. IUPAC: 3-[5,14-dihydroxy-3-(5-hydroxy-4-methoxy-6-methyloxan-2-yl)oxy-10,13-dimethyl-2,3,4,6,7,8,9,11,12,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2H-furan-5-one.
Chemical Property Profile of 杠柳心苷
Property Insights of 杠柳心苷
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 杠柳心苷. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 杠柳心苷. Following Lipinski's Rule of Five, 杠柳心苷 has 3 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 杠柳心苷?
The CAS number of 杠柳心苷 is 32476-67-8.
What is the molecular formula of 杠柳心苷?
The molecular formula of 杠柳心苷 is C30H46O8.
What is the molecular weight of 杠柳心苷?
The molecular weight of 杠柳心苷 is 534.32 g/mol.
Where can I buy 杠柳心苷?
You can request a quote for 杠柳心苷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 杠柳心苷?
Yes, KEHONG BIO provides custom synthesis services for 杠柳心苷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.