Benastatin C
TL;DR: Benastatin C (CAS 150151-88-5) is a chemical compound with molecular formula C29H28O5 and molecular weight 456.19366 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1,7,9,11-tetrahydroxy-13,13-dimethyl-3-pentylbenzo[a]tetracen-8-one
Also Known As: Benastatin C, benastatinC, 1,7,9,11-tetrahydroxy-13,13-dimethyl-3-pentylbenzo[a]tetracen-8-one, 13,13-Dimethyl-3-pentyl-1,7,9,11-tetrahydroxybenzo(a)naphthacen-8(13H)-one, 1,7,9,11-Tetrahydroxy-13,13-dimethyl-3-pentylbenzo[a]tetracen-8(13H)-one
Technical Specifications
| Molecular Formula | C29H28O5 |
| Molecular Weight | 456.19366 g/mol |
| XLogP | 8.3 |
| Topological Polar Surface Area (TPSA) | 98.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Exact Mass | 456.19366 Da |
| Heavy Atoms | 34 |
| Complexity | 751.0 |
| SMILES | CCCCCC1=CC(=C2C(=C1)C=CC3=C(C4=C(C=C32)C(C5=C(C4=O)C(=CC(=C5)O)O)(C)C)O)O |
| InChIKey | QUNHGOCXEGJZAT-UHFFFAOYSA-N |
Chemical Property Profile of Benastatin C
Property Insights of Benastatin C
The XLogP value of 8.3 indicates that Benastatin C is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 98.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Benastatin C. Following Lipinski's Rule of Five, Benastatin C has 4 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Benastatin C?
The CAS number of Benastatin C is 150151-88-5.
What is the molecular formula of Benastatin C?
The molecular formula of Benastatin C is C29H28O5.
What is the molecular weight of Benastatin C?
The molecular weight of Benastatin C is 456.19366 g/mol.
Where can I buy Benastatin C?
You can request a quote for Benastatin C directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Benastatin C?
Yes, CoreyChem provides custom synthesis services for Benastatin C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.