Ifflaionic acid
TL;DR: Ifflaionic acid (CAS 6826-33-1) is a chemical compound with molecular formula C30H46O3 and molecular weight 454.34 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Ifflaionic acid
(1R,2R,4aR,6aR,6aS,6bR,8aR,12aR,14bR)-1,4a,6a,6b,9,9,12a-heptamethyl-10-oxo-1,2,3,4,5,6,6a,7,8,8a,11,12,13,14b-tetradecahydropicene-2-carboxylic acid
Also Known As: Ifflaionic acid, 3-oxours-12-en-30-oic acid, (1R,2R,4aR,6aR,6aS,6bR,8aR,12aR,14bR)-1,4a,6a,6b,9,9,12a-heptamethyl-10-oxo-1,2,3,4,5,6,6a,7,8,8a,11,12,13,14b-tetradecahydropicene-2-carboxylic acid, (1R,2R,4aR,6aS,6bR,8aR,12aR,12bR,14bR)-1,4a,6a,6b,9,9,12a-heptamethyl-10-oxo-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,12b,13,14b-icosahydropicene-2-carboxylic acid
| Molecular Formula | C30H46O3 |
|---|---|
| Molecular Weight | 454.34 g/mol |
| LogP | 7.2 |
| Topological Polar Surface Area | 54.4 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 454.3447 |
| Heavy Atoms | 33 |
| Complexity | 916.0 |
Chemical Identifiers
| CAS Number | 6826-33-1 |
|---|---|
| SMILES | C[C@H]1[C@@H](CC[C@]2([C@@H]1C3=CC[C@@H]4[C@]5(CCC(=O)C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)C)C)C(=O)O |
| InChIKey | DQOFFNPCGATPDE-MXMXHWDASA-N |
Product Overview
Ifflaionic acid (CAS 6826-33-1), with molecular formula C30H46O3 and molecular weight 454.34 g/mol. IUPAC: (1R,2R,4aR,6aR,6aS,6bR,8aR,12aR,14bR)-1,4a,6a,6b,9,9,12a-heptamethyl-10-oxo-1,2,3,4,5,6,6a,7,8,8a,11,12,13,14b-tetradecahydropicene-2-carboxylic acid.
Chemical Property Profile of Ifflaionic acid
Property Insights of Ifflaionic acid
The XLogP value of 7.2 indicates that Ifflaionic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.4 Ų, Ifflaionic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Ifflaionic acid has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Ifflaionic acid?
The CAS number of Ifflaionic acid is 6826-33-1.
What is the molecular formula of Ifflaionic acid?
The molecular formula of Ifflaionic acid is C30H46O3.
What is the molecular weight of Ifflaionic acid?
The molecular weight of Ifflaionic acid is 454.34 g/mol.
Where can I buy Ifflaionic acid?
You can request a quote for Ifflaionic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Ifflaionic acid?
Yes, KEHONG BIO provides custom synthesis services for Ifflaionic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.