Trichoverrol B
TL;DR: Trichoverrol B (CAS 76685-83-1) is a chemical compound with molecular formula C23H32O7 and molecular weight 420.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S,2R,7R,9R,11R,12S)-2-(hydroxymethyl)-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-11-yl] (2Z,4E,6S,7R)-6,7-dihydroxyocta-2,4-dienoate
Also Known As: Trichoverrol B, Trichoverrol A, J1.002.163D, [(1S,2R,7R,9R,11R,12S)-2-(hydroxymethyl)-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-11-yl] (2Z,4E,6S,7R)-6,7-dihydroxyocta-2,4-dienoate, Trichothec-9-ene-4,15-diol, 12,13-epoxy-, 4-((2Z,4E,6S,7R)-6,7-dihydroxy-2,4-octadienoate), (4beta)-
| Molecular Formula | C23H32O7 |
|---|---|
| Molecular Weight | 420.21 g/mol |
| LogP | 1.4175 |
| Topological Polar Surface Area | 108.75 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 6 |
| Exact Mass | 420.2148 |
| Heavy Atoms | 30 |
| Complexity | 780.42114 |
Chemical Identifiers
| CAS Number | 76685-83-1 |
|---|---|
| SMILES | CC1=C[C@@H]2[C@](CC1)([C@]3([C@@H](C[C@H]([C@@]34CO4)O2)OC(=O)/C=C\C=C\[C@@H]([C@@H](C)O)O)C)CO |
Product Overview
Trichoverrol B (CAS 76685-83-1), with molecular formula C23H32O7 and molecular weight 420.21 g/mol. IUPAC: [(1S,2R,7R,9R,11R,12S)-2-(hydroxymethyl)-1,5-dimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-11-yl] (2Z,4E,6S,7R)-6,7-dihydroxyocta-2,4-dienoate.
Chemical Property Profile of Trichoverrol B
Property Insights of Trichoverrol B
The XLogP value of 1.4175 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Trichoverrol B. The TPSA of 108.75 Ų falls within the moderate polarity range, balancing permeability and solubility for Trichoverrol B. Following Lipinski's Rule of Five, Trichoverrol B 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 Trichoverrol B?
The CAS number of Trichoverrol B is 76685-83-1.
What is the molecular formula of Trichoverrol B?
The molecular formula of Trichoverrol B is C23H32O7.
What is the molecular weight of Trichoverrol B?
The molecular weight of Trichoverrol B is 420.21 g/mol.
Where can I buy Trichoverrol B?
You can request a quote for Trichoverrol B directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trichoverrol B?
Yes, KEHONG BIO provides custom synthesis services for Trichoverrol B and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.