Periplocymarin
TL;DR: Periplocymarin (CAS 127-32-2) 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.
3-[(3S,5S,10R,13R,14S,17R)-5,14-dihydroxy-3-[(2R,5R)-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, Periplogenin + D-cymarose [German], 3-[(3S,5S,10R,13R,14S,17R)-5,14-dihydroxy-3-[(2R,5R)-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, 3-[(2,6-Dideoxy-3-O-methylhexopyranosyl)oxy]-5,14-dihydroxycard-20(22)-enolide, (8xi,9xi)-3beta-[(2,6-Dideoxy-3-O-methyl-beta-D-glycero-hexopyranosyl)oxy]-5,14-dihydroxy-5beta-card-20(22)-enolide
| 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 | 127-32-2 |
|---|---|
| SMILES | CC1[C@H](C(C[C@@H](O1)O[C@H]2CC[C@@]3(C4CC[C@@]5([C@H](CC[C@@]5(C4CC[C@@]3(C2)O)O)C6=CC(=O)OC6)C)C)OC)O |
| InChIKey | XRWQBDJPMXRDOQ-KJVXBACWSA-N |
Product Overview
Periplocymarin (CAS 127-32-2), with molecular formula C30H46O8 and molecular weight 534.32 g/mol. IUPAC: 3-[(3S,5S,10R,13R,14S,17R)-5,14-dihydroxy-3-[(2R,5R)-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 Periplocymarin
Property Insights of Periplocymarin
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Periplocymarin. The TPSA of 115.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Periplocymarin. Following Lipinski's Rule of Five, Periplocymarin 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 Periplocymarin?
The CAS number of Periplocymarin is 127-32-2.
What is the molecular formula of Periplocymarin?
The molecular formula of Periplocymarin is C30H46O8.
What is the molecular weight of Periplocymarin?
The molecular weight of Periplocymarin is 534.32 g/mol.
Where can I buy Periplocymarin?
You can request a quote for Periplocymarin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Periplocymarin?
Yes, KEHONG BIO provides custom synthesis services for Periplocymarin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.