Trichoderonin
TL;DR: Trichoderonin (CAS 4682-50-2) is a chemical compound with molecular formula C17H24O4 and molecular weight 292.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(1S,2R,7R,9R,11R,12S)-1,2,5-trimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-11-yl] acetate
Also Known As: Trichodermin, Trichoderonin, ND 8, TRICHODERMIN [MI], WG 696
| Molecular Formula | C17H24O4 |
|---|---|
| Molecular Weight | 292.17 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 48.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Exact Mass | 292.16745 |
| Heavy Atoms | 21 |
| Complexity | 541.0 |
Chemical Identifiers
| CAS Number | 4682-50-2 |
|---|---|
| SMILES | CC1=C[C@@H]2[C@](CC1)([C@]3([C@@H](C[C@H]([C@@]34CO4)O2)OC(=O)C)C)C |
| InChIKey | HNEGCRMUYSKRRR-IKIFYQGPSA-N |
Product Overview
Trichoderonin (CAS 4682-50-2), with molecular formula C17H24O4 and molecular weight 292.17 g/mol. IUPAC: [(1S,2R,7R,9R,11R,12S)-1,2,5-trimethylspiro[8-oxatricyclo[7.2.1.02,7]dodec-5-ene-12,2'-oxirane]-11-yl] acetate.
Chemical Property Profile of Trichoderonin
Property Insights of Trichoderonin
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Trichoderonin. With a topological polar surface area (TPSA) of 48.1 Ų, Trichoderonin exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Trichoderonin has 0 hydrogen bond donor(s) and 4 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 Trichoderonin?
The CAS number of Trichoderonin is 4682-50-2.
What is the molecular formula of Trichoderonin?
The molecular formula of Trichoderonin is C17H24O4.
What is the molecular weight of Trichoderonin?
The molecular weight of Trichoderonin is 292.17 g/mol.
Where can I buy Trichoderonin?
You can request a quote for Trichoderonin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Trichoderonin?
Yes, KEHONG BIO provides custom synthesis services for Trichoderonin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.