OBACUNOIC ACID
TL;DR: OBACUNOIC ACID (CAS 751-29-1) is a chemical compound with molecular formula C26H32O8 and molecular weight 472.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[11-(furan-3-yl)-5-(2-hydroxypropan-2-yl)-2,6,10-trimethyl-3,13-dioxo-12,15-dioxatetracyclo[8.5.0.01,14.02,7]pentadecan-6-yl]prop-2-enoic acid
Also Known As: OBACUNOIC ACID
| Molecular Formula | C26H32O8 |
|---|---|
| Molecular Weight | 472.21 g/mol |
| LogP | 3.4447 |
| Topological Polar Surface Area | 126.57 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 472.20972 |
| Heavy Atoms | 34 |
| Complexity | 1082.7742 |
Chemical Identifiers
| CAS Number | 751-29-1 |
|---|---|
| SMILES | CC12CCC3C(C(CC(=O)C3(C14C(O4)C(=O)OC2C5=COC=C5)C)C(C)(C)O)(C)C=CC(=O)O |
Product Overview
OBACUNOIC ACID (CAS 751-29-1), with molecular formula C26H32O8 and molecular weight 472.21 g/mol. IUPAC: 3-[11-(furan-3-yl)-5-(2-hydroxypropan-2-yl)-2,6,10-trimethyl-3,13-dioxo-12,15-dioxatetracyclo[8.5.0.01,14.02,7]pentadecan-6-yl]prop-2-enoic acid.
Chemical Property Profile of OBACUNOIC ACID
Property Insights of OBACUNOIC ACID
The XLogP value of 3.4447 indicates that OBACUNOIC ACID is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 126.57 Ų falls within the moderate polarity range, balancing permeability and solubility for OBACUNOIC ACID. Following Lipinski's Rule of Five, OBACUNOIC ACID has 2 hydrogen bond donor(s) and 7 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 OBACUNOIC ACID?
The CAS number of OBACUNOIC ACID is 751-29-1.
What is the molecular formula of OBACUNOIC ACID?
The molecular formula of OBACUNOIC ACID is C26H32O8.
What is the molecular weight of OBACUNOIC ACID?
The molecular weight of OBACUNOIC ACID is 472.21 g/mol.
Where can I buy OBACUNOIC ACID?
You can request a quote for OBACUNOIC ACID directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for OBACUNOIC ACID?
Yes, KEHONG BIO provides custom synthesis services for OBACUNOIC ACID and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.