Linimacrin e
TL;DR: Linimacrin e (CAS 82535-39-5) is a chemical compound with molecular formula C36H50O8 and molecular weight 610.35 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,2R,4R,6S,7S,9R,10S,11S,12S,13S,14S,15R,23S,25R)-9-(hydroxymethyl)-2,13,15-trimethyl-12-phenoxy-4-prop-1-en-2-yl-8,24,26,27-tetraoxaheptacyclo[12.10.1.14,23.15,23.01,6.07,9.011,25]heptacosane-10,11-diol
Also Known As: Linimacrin e, 16aH-1,6:2,6-Diepoxybenz(7,8)oxireno(5,6)azuleno(8,1-bc)oxacyclotridecin-16,16a,17-triol, eicosahydro-17a-(hydroxymethyl)-4,14,15-trimethyl-2-(1-methylethenyl)-, 16-benzoate, (1R,2R,4R,4aR,6S,14S,14aR,15S,16S,16aS,16bR,17S,17aR,18aS,18bS)-, (2S,10R,10aS,11S,12S,12aS,13S,13aR,14aS,14bS,16R,18R,18aR,18bR)-13a-(Hydroxymethyl)-10,11,18-trimethyl-12-phenoxy-16-(prop-1-en-2-yl)icosahydro-12aH-2,15:2,16-diepoxybenzo[7,8]oxireno[5,6]azuleno[8,1-bc]oxacyclotridecine-12a,13-diol, 13a-(Hydroxymethyl)-10,11,18-trimethyl-12-phenoxy-16-(prop-1-en-2-yl)icosahydro-12aH-2,15:2,16-diepoxybenzo[7,8]oxireno[5,6]azuleno[8,1-bc]oxacyclotridecine-12a,13-diol
| Molecular Formula | C36H50O8 |
|---|---|
| Molecular Weight | 610.35 g/mol |
| LogP | 4.7411 |
| Topological Polar Surface Area | 110.14 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 4 |
| Exact Mass | 610.3506 |
| Heavy Atoms | 44 |
| Complexity | 1306.0602 |
Chemical Identifiers
| CAS Number | 82535-39-5 |
|---|---|
| SMILES | C[C@@H]1CCCCCCC[C@]23OC4[C@@H]5[C@H]6[C@](O6)([C@H]([C@]7([C@@H]([C@@H]1[C@@H]([C@@H]7OC8=CC=CC=C8)C)[C@@]5(O2)[C@@H](C[C@@]4(O3)C(=C)C)C)O)O)CO |
Product Overview
Linimacrin e (CAS 82535-39-5), with molecular formula C36H50O8 and molecular weight 610.35 g/mol. IUPAC: (1R,2R,4R,6S,7S,9R,10S,11S,12S,13S,14S,15R,23S,25R)-9-(hydroxymethyl)-2,13,15-trimethyl-12-phenoxy-4-prop-1-en-2-yl-8,24,26,27-tetraoxaheptacyclo[12.10.1.14,23.15,23.01,6.07,9.011,25]heptacosane-10,11-diol.
Chemical Property Profile of Linimacrin e
Property Insights of Linimacrin e
The XLogP value of 4.7411 indicates that Linimacrin e is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 110.14 Ų falls within the moderate polarity range, balancing permeability and solubility for Linimacrin e. Following Lipinski's Rule of Five, Linimacrin e 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 Linimacrin e?
The CAS number of Linimacrin e is 82535-39-5.
What is the molecular formula of Linimacrin e?
The molecular formula of Linimacrin e is C36H50O8.
What is the molecular weight of Linimacrin e?
The molecular weight of Linimacrin e is 610.35 g/mol.
Where can I buy Linimacrin e?
You can request a quote for Linimacrin e directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Linimacrin e?
Yes, KEHONG BIO provides custom synthesis services for Linimacrin e and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.