Bipinnatin B
TL;DR: Bipinnatin B (CAS 6340-05-2) is a chemical compound with molecular formula C24H26O10 and molecular weight 474.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[5-acetyloxy-7,12-dimethyl-17-oxo-4-(3-oxoprop-1-en-2-yl)-11,16,18,19-tetraoxapentacyclo[12.2.2.16,9.01,15.010,12]nonadeca-6,8-dien-2-yl] acetate
Also Known As: Bipinnatin B, Bipinnatin-B, 7,12-dimethyl-17-oxo-4-(3-oxoprop-1-en-2-yl)-11,16,18,19-tetraoxapentacyclo[12.2.2.16,9.01,15.010,12]nonadeca-6,8-diene-2,5-diyl diacetate, [5-acetyloxy-7,12-dimethyl-17-oxo-4-(3-oxoprop-1-en-2-yl)-11,16,18,19-tetraoxapentacyclo[12.2.2.16,9.01,15.010,12]nonadeca-6,8-dien-2-yl] acetate, 1~4~,2~3~-Dimethyl-4~2~-oxo-7-(3-oxoprop-1-en-2-yl)-4~3~,4~6~-dioxa-1(2,5)-furana-2(2,3)-oxirana-4(4,1)-bicyclo[3.1.0]hexanacyclooctaphane-5,8-diyl diacetate
| Molecular Formula | C24H26O10 |
|---|---|
| Molecular Weight | 474.15 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 134.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 6 |
| Exact Mass | 474.1526 |
| Heavy Atoms | 34 |
| Complexity | 946.0 |
Chemical Identifiers
| CAS Number | 6340-05-2 |
|---|---|
| SMILES | CC1=C2C(C(CC(C34C(O3)C(CC5(C(O5)C(=C1)O2)C)OC4=O)OC(=O)C)C(=C)C=O)OC(=O)C |
| InChIKey | MEFFELURXRIWBN-UHFFFAOYSA-N |
Product Overview
Bipinnatin B (CAS 6340-05-2), with molecular formula C24H26O10 and molecular weight 474.15 g/mol. IUPAC: [5-acetyloxy-7,12-dimethyl-17-oxo-4-(3-oxoprop-1-en-2-yl)-11,16,18,19-tetraoxapentacyclo[12.2.2.16,9.01,15.010,12]nonadeca-6,8-dien-2-yl] acetate.
Chemical Property Profile of Bipinnatin B
Property Insights of Bipinnatin B
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Bipinnatin B. The TPSA of 134.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Bipinnatin B. Following Lipinski's Rule of Five, Bipinnatin B has 0 hydrogen bond donor(s) and 10 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 Bipinnatin B?
The CAS number of Bipinnatin B is 6340-05-2.
What is the molecular formula of Bipinnatin B?
The molecular formula of Bipinnatin B is C24H26O10.
What is the molecular weight of Bipinnatin B?
The molecular weight of Bipinnatin B is 474.15 g/mol.
Where can I buy Bipinnatin B?
You can request a quote for Bipinnatin B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bipinnatin B?
Yes, KEHONG BIO provides custom synthesis services for Bipinnatin B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.