Gnidimacrin-20-palmitate
TL;DR: Gnidimacrin-20-palmitate (CAS 60796-71-6) is a chemical compound with molecular formula C60H84O13 and molecular weight 1012.59 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[12-benzoyloxy-9-(hexadecanoyloxymethyl)-10,11,22-trihydroxy-13,15-dimethyl-4-prop-1-en-2-yl-8,24,26,27-tetraoxaheptacyclo[12.10.1.14,23.15,23.01,6.07,9.011,25]heptacosan-2-yl]methyl benzoate
Also Known As: Gnidimacrin-20-palmitate, Gnidimacrin, 20-hexadecanoate, Gnidimacrin 20-palmitate, GNIDIA B637436K180 ORIGIN, Hexadecanoic acid, (16-(benzoyloxy)-4-((benzoyloxy)methyl)eicosahydro-7,16a,17-trihydroxy-14,15-dimethyl-2-(1-methylethenyl)-17aH-1,6:2,6-diepoxybenz(7,8)oxireno(5,6)azuleno(8,1-bc)oxacyclotridecin-17a-yl)methyl ester, (1R-(1R*,2R*,4S*,4aR*,6S*,7R*,14R*,14aS*,15S*,16S*,16aS*,16bR*,17S*,17aR*,18aS*,18bS*))-
| Molecular Formula | C60H84O13 |
|---|---|
| Molecular Weight | 1012.59 g/mol |
| LogP | 13.4 |
| Topological Polar Surface Area | 180.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 25 |
| Exact Mass | 1012.5912 |
| Heavy Atoms | 73 |
| Complexity | 1900.0 |
Chemical Identifiers
| CAS Number | 60796-71-6 |
|---|---|
| SMILES | CCCCCCCCCCCCCCCC(=O)OCC12C(O1)C3C4C5(CC(C36C7C(C(CCCCCCC(C(O4)(O5)O6)O)C)C(C(C7(C2O)O)OC(=O)C8=CC=CC=C8)C)COC(=O)C9=CC=CC=C9)C(=C)C |
| InChIKey | FIXBTCJNFYGENP-UHFFFAOYSA-N |
Product Overview
Gnidimacrin-20-palmitate (CAS 60796-71-6), with molecular formula C60H84O13 and molecular weight 1012.59 g/mol. IUPAC: [12-benzoyloxy-9-(hexadecanoyloxymethyl)-10,11,22-trihydroxy-13,15-dimethyl-4-prop-1-en-2-yl-8,24,26,27-tetraoxaheptacyclo[12.10.1.14,23.15,23.01,6.07,9.011,25]heptacosan-2-yl]methyl benzoate.
Chemical Property Profile of Gnidimacrin-20-palmitate
Property Insights of Gnidimacrin-20-palmitate
The XLogP value of 13.4 indicates that Gnidimacrin-20-palmitate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 180.0 Ų indicates high polarity, suggesting Gnidimacrin-20-palmitate may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Gnidimacrin-20-palmitate has 3 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Gnidimacrin-20-palmitate?
The CAS number of Gnidimacrin-20-palmitate is 60796-71-6.
What is the molecular formula of Gnidimacrin-20-palmitate?
The molecular formula of Gnidimacrin-20-palmitate is C60H84O13.
What is the molecular weight of Gnidimacrin-20-palmitate?
The molecular weight of Gnidimacrin-20-palmitate is 1012.59 g/mol.
Where can I buy Gnidimacrin-20-palmitate?
You can request a quote for Gnidimacrin-20-palmitate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Gnidimacrin-20-palmitate?
Yes, KEHONG BIO provides custom synthesis services for Gnidimacrin-20-palmitate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.