Sakyomicin C
TL;DR: Sakyomicin C (CAS 86413-76-5) is a chemical compound with molecular formula C25H26O9 and molecular weight 470.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3R,4aR,12bS)-3,4a,8-trihydroxy-12b-[(2R,5R,6R)-5-hydroxy-6-methyloxan-2-yl]oxy-3-methyl-2,4-dihydrobenzo[a]anthracene-1,7,12-trione
Also Known As: Sakyomicin C, (3R,4aR,12bS)-3,4a,8-trihydroxy-12b-[(2R,5R,6R)-5-hydroxy-6-methyloxan-2-yl]oxy-3-methyl-2,4-dihydrobenzo[a]anthracene-1,7,12-trione, (3R,4aR,12bS)-3,4a,8-trihydroxy-12b-((2R,5R,6R)-5-hydroxy-6-methyloxan-2-yl)oxy-3-methyl-2,4-dihydrobenzo(a)anthracene-1,7,12-trione, (3R,4aR,12bS)-3,4a,8-Trihydroxy-12b-{[(2R,5R,6R)-5-hydroxy-6-methyloxan-2-yl]oxy}-3-methyl-3,4,4a,12b-tetrahydrotetraphene-1,7,12(2H)-trione, 3,4a,8-Trihydroxy-12b-[(5-hydroxy-6-methyloxan-2-yl)oxy]-3-methyl-3,4,4a,12b-tetrahydrotetraphene-1,7,12(2H)-trione
| Molecular Formula | C25H26O9 |
|---|---|
| Molecular Weight | 470.16 g/mol |
| LogP | 0.7 |
| Topological Polar Surface Area | 151.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 2 |
| Exact Mass | 470.15768 |
| Heavy Atoms | 34 |
| Complexity | 1000.0 |
Chemical Identifiers
| CAS Number | 86413-76-5 |
|---|---|
| SMILES | C[C@@H]1[C@@H](CC[C@H](O1)O[C@]23C(=O)C[C@](C[C@]2(C=CC4=C3C(=O)C5=C(C4=O)C(=CC=C5)O)O)(C)O)O |
| InChIKey | DSMQDARJKCLOPP-IHCLWORPSA-N |
Product Overview
Sakyomicin C (CAS 86413-76-5), with molecular formula C25H26O9 and molecular weight 470.16 g/mol. IUPAC: (3R,4aR,12bS)-3,4a,8-trihydroxy-12b-[(2R,5R,6R)-5-hydroxy-6-methyloxan-2-yl]oxy-3-methyl-2,4-dihydrobenzo[a]anthracene-1,7,12-trione.
Chemical Property Profile of Sakyomicin C
Property Insights of Sakyomicin C
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Sakyomicin C. The TPSA of 151.0 Ų indicates high polarity, suggesting Sakyomicin C may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Sakyomicin C has 4 hydrogen bond donor(s) and 9 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 Sakyomicin C?
The CAS number of Sakyomicin C is 86413-76-5.
What is the molecular formula of Sakyomicin C?
The molecular formula of Sakyomicin C is C25H26O9.
What is the molecular weight of Sakyomicin C?
The molecular weight of Sakyomicin C is 470.16 g/mol.
Where can I buy Sakyomicin C?
You can request a quote for Sakyomicin C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Sakyomicin C?
Yes, KEHONG BIO provides custom synthesis services for Sakyomicin C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.