Tryptoquivaline
TL;DR: Tryptoquivaline (CAS 55387-45-6) is a chemical compound with molecular formula C29H30N4O7 and molecular weight 546.2114 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[(1S)-1-[3-[(3'R,3aS,4S)-3-hydroxy-2,2-dimethyl-1,2'-dioxospiro[3aH-imidazo[1,2-a]indole-4,5'-oxolane]-3'-yl]-4-oxoquinazolin-2-yl]-2-methylpropyl] acetate
Also Known As: Tryptoquivaline, Fumitremorgin C, (+)-tryptoquivaline, TRYPTOQUIVALINE A, TRYPTOQUIVALINE C
Technical Specifications
| Molecular Formula | C29H30N4O7 |
| Molecular Weight | 546.2114 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 129.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 546.2114 Da |
| Heavy Atoms | 40 |
| Complexity | 1150.0 |
| SMILES | CC(C)[C@@H](C1=NC2=CC=CC=C2C(=O)N1[C@@H]3C[C@]4([C@H]5N(C6=CC=CC=C64)C(=O)C(N5O)(C)C)OC3=O)OC(=O)C |
| InChIKey | CYNVLFGDEQQUPE-LDWWEUSWSA-N |
Chemical Property Profile of Tryptoquivaline
Property Insights of Tryptoquivaline
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Tryptoquivaline. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Tryptoquivaline. Following Lipinski's Rule of Five, Tryptoquivaline has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Tryptoquivaline?
The CAS number of Tryptoquivaline is 55387-45-6.
What is the molecular formula of Tryptoquivaline?
The molecular formula of Tryptoquivaline is C29H30N4O7.
What is the molecular weight of Tryptoquivaline?
The molecular weight of Tryptoquivaline is 546.2114 g/mol.
Where can I buy Tryptoquivaline?
You can request a quote for Tryptoquivaline directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Tryptoquivaline?
Yes, CoreyChem provides custom synthesis services for Tryptoquivaline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.