山丘霉素
TL;DR: 山丘霉素 (CAS 1393-16-4) is a chemical compound with molecular formula C27H20O12 and molecular weight 536.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
山丘霉素
methyl 7,8-dihydroxy-6-[2-(8-hydroxy-5,7-dimethoxy-4,9-dioxobenzo[f][1]benzofuran-2-yl)ethyl]-1-oxoisochromene-3-carboxylate
Also Known As: Collinomycin, alpha-Rubromycin, Rubromycin, Tuoromycin, .alpha.-Rubromycin
| Molecular Formula | C27H20O12 |
|---|---|
| Molecular Weight | 536.10 g/mol |
| LogP | 2.8672 |
| Topological Polar Surface Area | 182.94 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 6 |
| Exact Mass | 536.09546 |
| Heavy Atoms | 39 |
| Complexity | 1772.3099 |
Chemical Identifiers
| CAS Number | 1393-16-4 |
|---|---|
| SMILES | COC1=CC(=C(C2=C1C(=O)C3=C(C2=O)OC(=C3)CCC4=C(C(=C5C(=C4)C=C(OC5=O)C(=O)OC)O)O)O)OC |
Product Overview
山丘霉素 (CAS 1393-16-4), with molecular formula C27H20O12 and molecular weight 536.10 g/mol. IUPAC: methyl 7,8-dihydroxy-6-[2-(8-hydroxy-5,7-dimethoxy-4,9-dioxobenzo[f][1]benzofuran-2-yl)ethyl]-1-oxoisochromene-3-carboxylate.
Chemical Property Profile of 山丘霉素
Property Insights of 山丘霉素
The XLogP value of 2.8672 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 山丘霉素. The TPSA of 182.94 Ų indicates high polarity, suggesting 山丘霉素 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 山丘霉素 has 3 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 山丘霉素?
The CAS number of 山丘霉素 is 1393-16-4.
What is the molecular formula of 山丘霉素?
The molecular formula of 山丘霉素 is C27H20O12.
What is the molecular weight of 山丘霉素?
The molecular weight of 山丘霉素 is 536.10 g/mol.
Where can I buy 山丘霉素?
You can request a quote for 山丘霉素 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 山丘霉素?
Yes, KEHONG BIO provides custom synthesis services for 山丘霉素 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.