RefChem:435440
TL;DR: RefChem:435440 (CAS 14923-28-5) is a chemical compound with molecular formula C85H132O8 and molecular weight 1280.99 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-1-carbonyl)oxy-2,2-bis[(1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-1-carbonyl)oxymethyl]propyl] 1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-1-carboxylate
Also Known As: 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a-dimethyl-7-(1-methylethyl)-, 2,2-bis((((1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a-dimethyl-7-(1-methylethyl)-1-phenanthrenyl)carbonyl)oxy)methyl)-1,3-propanediyl ester, 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a-dimethyl-7-(1-methylethyl)-, 1,1'-(2,2-bis((((1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a-dimethyl-7-(1-methylethyl)-1-phenanthrenyl)carbonyl)oxy)methyl)-1,3-propanediyl) ester, 1-Phenanthrenecarboxylic acid, 1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a-dimethyl-7-(1-methylethyl)-, 2,2-bis[[[[1,2,3,4,4a,4b,5,6,7,9,10,10a-dodecahydro-1,4a-dimethyl-7-(1-methylethyl)-1-phenanthrenyl]carbonyl]oxy]methyl]-1,3-propanediyl ester, 3-{[18-oxoabiet-8(14)-en-18-yl]oxy}-2,2-bis({[18-oxoabiet-8(14)-en-18-yl]oxy}methyl)propyl abiet-8(14)-en-18-oate, [3-(1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-1-carbonyl)oxy-2,2-bis[(1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-1-carbonyl)oxymethyl]propyl] 1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-1-carboxylate
| Molecular Formula | C85H132O8 |
|---|---|
| Molecular Weight | 1280.99 g/mol |
| LogP | 22.8 |
| Topological Polar Surface Area | 105.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 20 |
| Exact Mass | 1280.9922 |
| Heavy Atoms | 93 |
| Complexity | 2550.0 |
Chemical Identifiers
| CAS Number | 14923-28-5 |
|---|---|
| SMILES | CC(C)C1CCC2C(=C1)CCC3C2(CCCC3(C)C(=O)OCC(COC(=O)C4(CCCC5(C4CCC6=CC(CCC65)C(C)C)C)C)(COC(=O)C7(CCCC8(C7CCC9=CC(CCC98)C(C)C)C)C)COC(=O)C1(CCCC2(C1CCC1=CC(CCC12)C(C)C)C)C)C |
| InChIKey | BCUDEFKEXDZXSG-UHFFFAOYSA-N |
Product Overview
RefChem:435440 (CAS 14923-28-5), with molecular formula C85H132O8 and molecular weight 1280.99 g/mol. IUPAC: [3-(1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-1-carbonyl)oxy-2,2-bis[(1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-1-carbonyl)oxymethyl]propyl] 1,4a-dimethyl-7-propan-2-yl-2,3,4,4b,5,6,7,9,10,10a-decahydrophenanthrene-1-carboxylate.
Chemical Property Profile of RefChem:435440
Property Insights of RefChem:435440
The XLogP value of 22.8 indicates that RefChem:435440 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 105.0 Ų falls within the moderate polarity range, balancing permeability and solubility for RefChem:435440. Following Lipinski's Rule of Five, RefChem:435440 has 0 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 RefChem:435440?
The CAS number of RefChem:435440 is 14923-28-5.
What is the molecular formula of RefChem:435440?
The molecular formula of RefChem:435440 is C85H132O8.
What is the molecular weight of RefChem:435440?
The molecular weight of RefChem:435440 is 1280.99 g/mol.
Where can I buy RefChem:435440?
You can request a quote for RefChem:435440 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for RefChem:435440?
Yes, KEHONG BIO provides custom synthesis services for RefChem:435440 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.