Nortryptoquivaline
TL;DR: Nortryptoquivaline (CAS 60676-56-4) is a chemical compound with molecular formula C28H28N4O7 and molecular weight 532.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[1-[3-(3-hydroxy-2-methyl-1,2'-dioxospiro[2,3a-dihydroimidazo[1,2-a]indole-4,5'-oxolane]-3'-yl)-4-oxoquinazolin-2-yl]-2-methylpropyl] acetate
Also Known As: Tryptoquivaline D, Fumitremorgin D, NORTRYPTOQUIVALINE, Nortryptoquivaline A, 2-Demethyltryptoquivaline
| Molecular Formula | C28H28N4O7 |
|---|---|
| Molecular Weight | 532.20 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 129.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 5 |
| Exact Mass | 532.1958 |
| Heavy Atoms | 39 |
| Complexity | 1110.0 |
Chemical Identifiers
| CAS Number | 60676-56-4 |
|---|---|
| SMILES | CC1C(=O)N2C(N1O)C3(CC(C(=O)O3)N4C(=O)C5=CC=CC=C5N=C4C(C(C)C)OC(=O)C)C6=CC=CC=C62 |
| InChIKey | HHNRKSWQUGTUBV-UHFFFAOYSA-N |
Product Overview
Nortryptoquivaline (CAS 60676-56-4), with molecular formula C28H28N4O7 and molecular weight 532.20 g/mol. IUPAC: [1-[3-(3-hydroxy-2-methyl-1,2'-dioxospiro[2,3a-dihydroimidazo[1,2-a]indole-4,5'-oxolane]-3'-yl)-4-oxoquinazolin-2-yl]-2-methylpropyl] acetate.
Chemical Property Profile of Nortryptoquivaline
Property Insights of Nortryptoquivaline
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Nortryptoquivaline. The TPSA of 129.0 Ų falls within the moderate polarity range, balancing permeability and solubility for Nortryptoquivaline. Following Lipinski's Rule of Five, Nortryptoquivaline has 1 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Nortryptoquivaline?
The CAS number of Nortryptoquivaline is 60676-56-4.
What is the molecular formula of Nortryptoquivaline?
The molecular formula of Nortryptoquivaline is C28H28N4O7.
What is the molecular weight of Nortryptoquivaline?
The molecular weight of Nortryptoquivaline is 532.20 g/mol.
Where can I buy Nortryptoquivaline?
You can request a quote for Nortryptoquivaline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Nortryptoquivaline?
Yes, KEHONG BIO provides custom synthesis services for Nortryptoquivaline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.