Daphnodorin C
TL;DR: Daphnodorin C (CAS 6341-93-1) is a chemical compound with molecular formula C32H49NO5 and molecular weight 527.36 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-(1,4-dimethyl-2,8-dioxabicyclo[3.2.1]octan-4-yl)-3-(1-methyl-14-propan-2-yl-12-azapentacyclo[8.6.0.02,13.03,7.07,11]hexadecan-2-yl)-1-oxopropan-2-yl] acetate
Also Known As: Daphnodorin C, KST-1B6714, 1-(1,4-dimethyl-2,8-dioxabicyclo[3.2.1]oct-4-yl)-3-[6a-methyl-9-(propan-2-yl)dodecahydro-10ah-10,3a,6-(epiminomethanetriyl)benzo[e]azulen-10a-yl]-1-oxopropan-2-yl acetate, [1-(1,4-Dimethyl-2,8-dioxabicyclo[3.2.1]octan-4-yl)-3-(1-methyl-14-propan-2-yl-12-azapentacyclo[8.6.0.02,13.03,7.07,11]hexadecan-2-yl)-1-oxopropan-2-yl] acetate, 1-(1,4-Dimethyl-2,8-dioxabicyclo[3.2.1]octan-4-yl)-3-[6a-methyl-9-(propan-2-yl)dodecahydro-10aH-10,3a,6-(epiminomethanetriyl)benzo[e]azulen-10a-yl]-1-oxopropan-2-yl acetate
| Molecular Formula | C32H49NO5 |
|---|---|
| Molecular Weight | 527.36 g/mol |
| LogP | 5.6 |
| Topological Polar Surface Area | 73.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 6 |
| Rotatable Bonds | 7 |
| Exact Mass | 527.3611 |
| Heavy Atoms | 38 |
| Complexity | 1040.0 |
Chemical Identifiers
| CAS Number | 6341-93-1 |
|---|---|
| SMILES | CC(C)C1CCC2(C3CCC45C3NC1C2(C4CCC5)CC(C(=O)C6(COC7(CCC6O7)C)C)OC(=O)C)C |
| InChIKey | HGRGIRWGMLFVRL-UHFFFAOYSA-N |
Product Overview
Daphnodorin C (CAS 6341-93-1), with molecular formula C32H49NO5 and molecular weight 527.36 g/mol. IUPAC: [1-(1,4-dimethyl-2,8-dioxabicyclo[3.2.1]octan-4-yl)-3-(1-methyl-14-propan-2-yl-12-azapentacyclo[8.6.0.02,13.03,7.07,11]hexadecan-2-yl)-1-oxopropan-2-yl] acetate.
Chemical Property Profile of Daphnodorin C
Property Insights of Daphnodorin C
The XLogP value of 5.6 indicates that Daphnodorin C is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 73.9 Ų falls within the moderate polarity range, balancing permeability and solubility for Daphnodorin C. Following Lipinski's Rule of Five, Daphnodorin C has 1 hydrogen bond donor(s) and 6 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Daphnodorin C?
The CAS number of Daphnodorin C is 6341-93-1.
What is the molecular formula of Daphnodorin C?
The molecular formula of Daphnodorin C is C32H49NO5.
What is the molecular weight of Daphnodorin C?
The molecular weight of Daphnodorin C is 527.36 g/mol.
Where can I buy Daphnodorin C?
You can request a quote for Daphnodorin C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Daphnodorin C?
Yes, KEHONG BIO provides custom synthesis services for Daphnodorin C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.