Acyl-hemiacetal sterigmatocystin
TL;DR: Acyl-hemiacetal sterigmatocystin (CAS 38746-54-2) is a chemical compound with molecular formula C20H16O8 and molecular weight 384.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(15-hydroxy-11-methoxy-13-oxo-6,8,20-trioxapentacyclo[10.8.0.02,9.03,7.014,19]icosa-1,9,11,14,16,18-hexaen-5-yl) acetate
Also Known As: Acyl-hemiacetal sterigmatocystin, beta-Acetoxydihydrosterigmatocystin, alpha-Acetoxydihydrosterigmatocystin, 7H-Furo(3',2':4,5)furo(2,3-c)xanthen-7-one, 2-(acetyloxy)-1,2,3a,12c-tetrahydro-8-hydroxy-6-methoxy-, 7H-Furo(3',2':4,5)furo(2,3-c)xanthen-7-one, 2-(acetyloxy)-2,3,3a,12c-tetrahydro-8-hydroxy-6-methoxy-, (2alpha,3aalpha,12calpha)-
| Molecular Formula | C20H16O8 |
|---|---|
| Molecular Weight | 384.08 g/mol |
| LogP | 2.772 |
| Topological Polar Surface Area | 104.43 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 2 |
| Exact Mass | 384.0845 |
| Heavy Atoms | 28 |
| Complexity | 1194.4808 |
Chemical Identifiers
| CAS Number | 38746-54-2 |
|---|---|
| SMILES | CC(=O)OC1CC2C(O1)OC3=CC(=C4C(=C23)OC5=CC=CC(=C5C4=O)O)OC |
Product Overview
Acyl-hemiacetal sterigmatocystin (CAS 38746-54-2), with molecular formula C20H16O8 and molecular weight 384.08 g/mol. IUPAC: (15-hydroxy-11-methoxy-13-oxo-6,8,20-trioxapentacyclo[10.8.0.02,9.03,7.014,19]icosa-1,9,11,14,16,18-hexaen-5-yl) acetate.
Chemical Property Profile of Acyl-hemiacetal sterigmatocystin
Property Insights of Acyl-hemiacetal sterigmatocystin
The XLogP value of 2.772 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Acyl-hemiacetal sterigmatocystin. The TPSA of 104.43 Ų falls within the moderate polarity range, balancing permeability and solubility for Acyl-hemiacetal sterigmatocystin. Following Lipinski's Rule of Five, Acyl-hemiacetal sterigmatocystin has 1 hydrogen bond donor(s) and 8 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 Acyl-hemiacetal sterigmatocystin?
The CAS number of Acyl-hemiacetal sterigmatocystin is 38746-54-2.
What is the molecular formula of Acyl-hemiacetal sterigmatocystin?
The molecular formula of Acyl-hemiacetal sterigmatocystin is C20H16O8.
What is the molecular weight of Acyl-hemiacetal sterigmatocystin?
The molecular weight of Acyl-hemiacetal sterigmatocystin is 384.08 g/mol.
Where can I buy Acyl-hemiacetal sterigmatocystin?
You can request a quote for Acyl-hemiacetal sterigmatocystin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Acyl-hemiacetal sterigmatocystin?
Yes, KEHONG BIO provides custom synthesis services for Acyl-hemiacetal sterigmatocystin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.