Polyalthialdoic acid
TL;DR: Polyalthialdoic acid (CAS 137109-33-2) is a chemical compound with molecular formula C20H30O3 and molecular weight 318.22 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Polyalthialdoic acid
(Z)-5-[(1S,2R,4aR,8aR)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-formylpent-2-enoic acid
Also Known As: Polyalthialdoic acid, 16-Oxocleroda-3,13(14)-dien-15-oic acid, (1S-(1alpha(Z),2beta,4abeta,8aalpha))-3-Formyl-5-(1,2,3,4,4a,7,8,8a-octahydro-1,2,4a,5-tetramethyl-1-naphthalenyl)-2-pentenoic acid, (Z)-5-[(1S,2R,4aR,8aR)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-formylpent-2-enoic acid, (Z)-5-((1S,2R,4aR,8aR)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl)-3-formylpent-2-enoic acid
| Molecular Formula | C20H30O3 |
|---|---|
| Molecular Weight | 318.22 g/mol |
| LogP | 4.7753 |
| Topological Polar Surface Area | 54.37 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 318.21948 |
| Heavy Atoms | 23 |
| Complexity | 545.09 |
Chemical Identifiers
| CAS Number | 137109-33-2 |
|---|---|
| SMILES | C[C@@H]1CC[C@@]2([C@@H]([C@@]1(C)CC/C(=C/C(=O)O)/C=O)CCC=C2C)C |
Product Overview
Polyalthialdoic acid (CAS 137109-33-2), with molecular formula C20H30O3 and molecular weight 318.22 g/mol. IUPAC: (Z)-5-[(1S,2R,4aR,8aR)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]-3-formylpent-2-enoic acid.
Chemical Property Profile of Polyalthialdoic acid
Property Insights of Polyalthialdoic acid
The XLogP value of 4.7753 indicates that Polyalthialdoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 54.37 Ų, Polyalthialdoic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Polyalthialdoic acid has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Polyalthialdoic acid?
The CAS number of Polyalthialdoic acid is 137109-33-2.
What is the molecular formula of Polyalthialdoic acid?
The molecular formula of Polyalthialdoic acid is C20H30O3.
What is the molecular weight of Polyalthialdoic acid?
The molecular weight of Polyalthialdoic acid is 318.22 g/mol.
Where can I buy Polyalthialdoic acid?
You can request a quote for Polyalthialdoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Polyalthialdoic acid?
Yes, KEHONG BIO provides custom synthesis services for Polyalthialdoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.