Genkwadaphnin
TL;DR: Genkwadaphnin (CAS 56748-14-2) is a chemical compound with molecular formula C34H34O10 and molecular weight 602.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1R,2R,6S,7S,8R,10S,11S,12R,14R,16S,17R,18R)-6,7-dihydroxy-8-(hydroxymethyl)-4,18-dimethyl-5-oxo-14-phenyl-16-prop-1-en-2-yl-9,13,15,19-tetraoxahexacyclo[12.4.1.01,11.02,6.08,10.012,16]nonadec-3-en-17-yl] benzoate
Also Known As: Genkwadaphnin, 12-beta-(Benzoyloxy)daphnetoxin, KST-1A6098, Daphnetoxin, 12-(benzoyloxy)-, (12beta)-, Daphnetoxin, 12-(benzoyloxy)-, (12-beta)-
| Molecular Formula | C34H34O10 |
|---|---|
| Molecular Weight | 602.22 g/mol |
| LogP | 2.7 |
| Topological Polar Surface Area | 144.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 602.2152 |
| Heavy Atoms | 44 |
| Complexity | 1320.0 |
Chemical Identifiers
| CAS Number | 56748-14-2 |
|---|---|
| SMILES | C[C@@H]1[C@H]([C@]2([C@H]3[C@H]4[C@]1([C@@H]5C=C(C(=O)[C@]5([C@@H]([C@@]6([C@H]4O6)CO)O)O)C)O[C@@](O3)(O2)C7=CC=CC=C7)C(=C)C)OC(=O)C8=CC=CC=C8 |
| InChIKey | QKMXESBAFIKRAD-LPHDITAFSA-N |
Product Overview
Genkwadaphnin (CAS 56748-14-2), with molecular formula C34H34O10 and molecular weight 602.22 g/mol. IUPAC: [(1R,2R,6S,7S,8R,10S,11S,12R,14R,16S,17R,18R)-6,7-dihydroxy-8-(hydroxymethyl)-4,18-dimethyl-5-oxo-14-phenyl-16-prop-1-en-2-yl-9,13,15,19-tetraoxahexacyclo[12.4.1.01,11.02,6.08,10.012,16]nonadec-3-en-17-yl] benzoate.
Chemical Property Profile of Genkwadaphnin
Property Insights of Genkwadaphnin
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Genkwadaphnin. The TPSA of 144.0 Ų indicates high polarity, suggesting Genkwadaphnin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Genkwadaphnin has 3 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Genkwadaphnin?
The CAS number of Genkwadaphnin is 56748-14-2.
What is the molecular formula of Genkwadaphnin?
The molecular formula of Genkwadaphnin is C34H34O10.
What is the molecular weight of Genkwadaphnin?
The molecular weight of Genkwadaphnin is 602.22 g/mol.
Where can I buy Genkwadaphnin?
You can request a quote for Genkwadaphnin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Genkwadaphnin?
Yes, KEHONG BIO provides custom synthesis services for Genkwadaphnin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.