Dictyoceratin A
TL;DR: Dictyoceratin A (CAS 104900-68-7) is a chemical compound with molecular formula C23H32O4 and molecular weight 372.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-[[(1R,2S,4aS,8aS)-1,2,4a-trimethyl-5-methylidene-3,4,6,7,8,8a-hexahydro-2H-naphthalen-1-yl]methyl]-4,5-dihydroxybenzoate
Also Known As: dictyoceratin A, methyl 3-[[(1R,2S,4aS,8aS)-1,2,4a-trimethyl-5-methylidene-3,4,6,7,8,8a-hexahydro-2H-naphthalen-1-yl]methyl]-4,5-dihydroxybenzoate, 5-[[(1R,8aalpha)-Decahydro-1beta,2beta,4abeta-trimethyl-5-methylenenaphthalene-1alpha-yl]methyl]-3,4-dihydroxybenzoic, 3-[[(1R,8aalpha)-Decahydro-1beta,2beta,4abeta-trimethyl-5-methylenenaphthalen-1alpha-yl]methyl]-4,5-dihydroxybenzoic acid methyl ester, 5-[[(1R,8aalpha)-Decahydro-1beta,2beta,4abeta-trimethyl-5-methylenenaphthalene-1alpha-yl]methyl]-3,4-dihydroxybenzoic acid methyl ester
| Molecular Formula | C23H32O4 |
|---|---|
| Molecular Weight | 372.23 g/mol |
| LogP | 5.2257 |
| Topological Polar Surface Area | 66.76 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 372.23007 |
| Heavy Atoms | 27 |
| Complexity | 767.887 |
Chemical Identifiers
| CAS Number | 104900-68-7 |
|---|---|
| SMILES | C[C@H]1CC[C@]2([C@H]([C@]1(C)CC3=C(C(=CC(=C3)C(=O)OC)O)O)CCCC2=C)C |
Product Overview
Dictyoceratin A (CAS 104900-68-7), with molecular formula C23H32O4 and molecular weight 372.23 g/mol. IUPAC: methyl 3-[[(1R,2S,4aS,8aS)-1,2,4a-trimethyl-5-methylidene-3,4,6,7,8,8a-hexahydro-2H-naphthalen-1-yl]methyl]-4,5-dihydroxybenzoate.
Chemical Property Profile of Dictyoceratin A
Property Insights of Dictyoceratin A
The XLogP value of 5.2257 indicates that Dictyoceratin A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 66.76 Ų falls within the moderate polarity range, balancing permeability and solubility for Dictyoceratin A. Following Lipinski's Rule of Five, Dictyoceratin A has 2 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Dictyoceratin A?
The CAS number of Dictyoceratin A is 104900-68-7.
What is the molecular formula of Dictyoceratin A?
The molecular formula of Dictyoceratin A is C23H32O4.
What is the molecular weight of Dictyoceratin A?
The molecular weight of Dictyoceratin A is 372.23 g/mol.
Where can I buy Dictyoceratin A?
You can request a quote for Dictyoceratin A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Dictyoceratin A?
Yes, KEHONG BIO provides custom synthesis services for Dictyoceratin A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.