Scuterivulactone D
TL;DR: Scuterivulactone D (CAS 112609-09-3) is a chemical compound with molecular formula C27H34O7 and molecular weight 470.23 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S,3S,4R,4aR,7R,8R,8aS)-3,7,8-trihydroxy-3,4,8,8a-tetramethyl-4-[(E)-2-(5-oxo-2H-furan-3-yl)ethenyl]-1,2,4a,5,6,7-hexahydronaphthalen-1-yl] benzoate
Also Known As: Scuterivulactone D, Scutellone D, (+)-Scuterivulactone D, [(1S,3S,4R,4aR,7R,8R,8aS)-3,7,8-trihydroxy-3,4,8,8a-tetramethyl-4-[(E)-2-(5-oxo-2H-furan-3-yl)ethenyl]-1,2,4a,5,6,7-hexahydronaphthalen-1-yl] benzoate, 2(5H)-Furanone, 4-(2-(4-(benzoyloxy)decahydro-2,5,6-trihydroxy-1,2,4a,5-tetramethyl-1-naphthalenyl)ethenyl)-, (1alpha(E),2alpha,4beta,4abeta,5alpha,6beta,8aalpha)-(+)-
| Molecular Formula | C27H34O7 |
|---|---|
| Molecular Weight | 470.23 g/mol |
| LogP | 2.9406 |
| Topological Polar Surface Area | 113.29 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 470.23044 |
| Heavy Atoms | 34 |
| Complexity | 1024.6741 |
Chemical Identifiers
| CAS Number | 112609-09-3 |
|---|---|
| SMILES | C[C@@]1(C[C@@H]([C@@]2([C@@H]([C@@]1(C)/C=C/C3=CC(=O)OC3)CC[C@H]([C@]2(C)O)O)C)OC(=O)C4=CC=CC=C4)O |
Product Overview
Scuterivulactone D (CAS 112609-09-3), with molecular formula C27H34O7 and molecular weight 470.23 g/mol. IUPAC: [(1S,3S,4R,4aR,7R,8R,8aS)-3,7,8-trihydroxy-3,4,8,8a-tetramethyl-4-[(E)-2-(5-oxo-2H-furan-3-yl)ethenyl]-1,2,4a,5,6,7-hexahydronaphthalen-1-yl] benzoate.
Chemical Property Profile of Scuterivulactone D
Property Insights of Scuterivulactone D
The XLogP value of 2.9406 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Scuterivulactone D. The TPSA of 113.29 Ų falls within the moderate polarity range, balancing permeability and solubility for Scuterivulactone D. Following Lipinski's Rule of Five, Scuterivulactone D has 3 hydrogen bond donor(s) and 7 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 Scuterivulactone D?
The CAS number of Scuterivulactone D is 112609-09-3.
What is the molecular formula of Scuterivulactone D?
The molecular formula of Scuterivulactone D is C27H34O7.
What is the molecular weight of Scuterivulactone D?
The molecular weight of Scuterivulactone D is 470.23 g/mol.
Where can I buy Scuterivulactone D?
You can request a quote for Scuterivulactone D directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Scuterivulactone D?
Yes, KEHONG BIO provides custom synthesis services for Scuterivulactone D and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.