Bis(helenalinyl)glutarate
TL;DR: Bis(helenalinyl)glutarate (CAS 77928-51-9) is a chemical compound with molecular formula C35H40O10 and molecular weight 620.26 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
bis[(3aR,5R,5aR,8aR,9S,9aR)-5,8a-dimethyl-1-methylidene-2,8-dioxo-3a,4,5,5a,9,9a-hexahydroazuleno[6,5-b]furan-9-yl] pentanedioate
Also Known As: Bis(helenalinyl)glutarate, Bis(helenalinyl) glutarate, bis-Helenalinyl-glutarate, NCI60_003153, bis[(3aR,5R,5aR,8aR,9S,9aR)-5,8a-dimethyl-1-methylidene-2,8-dioxo-3a,4,5,5a,9,9a-hexahydroazuleno[6,5-b]furan-9-yl] pentanedioate
| Molecular Formula | C35H40O10 |
|---|---|
| Molecular Weight | 620.26 g/mol |
| LogP | 4.0 |
| Topological Polar Surface Area | 139.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 8 |
| Exact Mass | 620.26215 |
| Heavy Atoms | 45 |
| Complexity | 1360.0 |
Chemical Identifiers
| CAS Number | 77928-51-9 |
|---|---|
| SMILES | C[C@@H]1C[C@@H]2[C@H]([C@@H]([C@]3([C@H]1C=CC3=O)C)OC(=O)CCCC(=O)O[C@H]4[C@H]5[C@@H](C[C@H]([C@H]6[C@]4(C(=O)C=C6)C)C)OC(=O)C5=C)C(=C)C(=O)O2 |
| InChIKey | PCLGLSWYMVOCFV-VSUOEQHXSA-N |
Product Overview
Bis(helenalinyl)glutarate (CAS 77928-51-9), with molecular formula C35H40O10 and molecular weight 620.26 g/mol. IUPAC: bis[(3aR,5R,5aR,8aR,9S,9aR)-5,8a-dimethyl-1-methylidene-2,8-dioxo-3a,4,5,5a,9,9a-hexahydroazuleno[6,5-b]furan-9-yl] pentanedioate.
Chemical Property Profile of Bis(helenalinyl)glutarate
Property Insights of Bis(helenalinyl)glutarate
The XLogP value of 4.0 indicates that Bis(helenalinyl)glutarate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 139.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Bis(helenalinyl)glutarate. Following Lipinski's Rule of Five, Bis(helenalinyl)glutarate has 0 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Bis(helenalinyl)glutarate?
The CAS number of Bis(helenalinyl)glutarate is 77928-51-9.
What is the molecular formula of Bis(helenalinyl)glutarate?
The molecular formula of Bis(helenalinyl)glutarate is C35H40O10.
What is the molecular weight of Bis(helenalinyl)glutarate?
The molecular weight of Bis(helenalinyl)glutarate is 620.26 g/mol.
Where can I buy Bis(helenalinyl)glutarate?
You can request a quote for Bis(helenalinyl)glutarate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Bis(helenalinyl)glutarate?
Yes, KEHONG BIO provides custom synthesis services for Bis(helenalinyl)glutarate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.