iso-FMN
TL;DR: iso-FMN (CAS 28848-42-2) is a chemical compound with molecular formula C17H21N4O9P and molecular weight 456.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2R,3S,4S)-5-(6,7-dimethyl-2,4-dioxobenzo[g]pteridin-10-yl)-2,3,4-trihydroxypentyl] dihydrogen phosphate
Also Known As: Iso-fmn, Isoflavin mononucleotide, 8-Demethyl-6-methylriboflavin 5 -phosphoric acid, Riboflavin 5'-(dihydrogen phosphate), 8-demethyl-6-methyl-, [(2R,3S,4S)-5-(6,7-dimethyl-2,4-dioxobenzo[g]pteridin-10-yl)-2,3,4-trihydroxypentyl] dihydrogen phosphate
| Molecular Formula | C17H21N4O9P |
|---|---|
| Molecular Weight | 456.10 g/mol |
| LogP | -1.60656 |
| Topological Polar Surface Area | 208.09 Ų |
| Hydrogen Bond Donors | 6 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 7 |
| Exact Mass | 456.1046 |
| Heavy Atoms | 31 |
| Complexity | 1250.7415 |
Chemical Identifiers
| CAS Number | 28848-42-2 |
|---|---|
| SMILES | CC1=C(C2=C(C=C1)N(C3=NC(=O)NC(=O)C3=N2)C[C@@H]([C@@H]([C@@H](COP(=O)(O)O)O)O)O)C |
Product Overview
iso-FMN (CAS 28848-42-2), with molecular formula C17H21N4O9P and molecular weight 456.10 g/mol. IUPAC: [(2R,3S,4S)-5-(6,7-dimethyl-2,4-dioxobenzo[g]pteridin-10-yl)-2,3,4-trihydroxypentyl] dihydrogen phosphate.
Chemical Property Profile of iso-FMN
Property Insights of iso-FMN
The XLogP value of -1.60656 indicates that iso-FMN is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 208.09 Ų indicates high polarity, suggesting iso-FMN may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, iso-FMN has 6 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 iso-FMN?
The CAS number of iso-FMN is 28848-42-2.
What is the molecular formula of iso-FMN?
The molecular formula of iso-FMN is C17H21N4O9P.
What is the molecular weight of iso-FMN?
The molecular weight of iso-FMN is 456.10 g/mol.
Where can I buy iso-FMN?
You can request a quote for iso-FMN directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for iso-FMN?
Yes, KEHONG BIO provides custom synthesis services for iso-FMN and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.