Formamicin
TL;DR: Formamicin (CAS 200497-99-0) is a chemical compound with molecular formula C44H72O13 and molecular weight 808.50 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,2E,4E,8R,9S,10E,12E,15S,16S,20S)-8-[(2S,3R,4S)-4-[(2R,4R,5R,6R)-4-[(2R,4R,5S,6R)-4,5-dihydroxy-6-methyloxan-2-yl]oxy-2-hydroxy-5,6-dimethyloxan-2-yl]-3-hydroxypentan-2-yl]-20-hydroxy-9-methoxy-1,3,13-trimethyl-16-pentyl-7,17,19-trioxabicyclo[13.4.1]icosa-2,4,10,12-tetraen-6-one
Also Known As: Formamicin, (1S,2E,4E,8R,9S,10E,12E,15S,16S,20S)-8-[(2S,3R,4S)-4-[(2R,4R,5R,6R)-4-[(2R,4R,5S,6R)-4,5-Dihydroxy-6-methyloxan-2-yl]oxy-2-hydroxy-5,6-dimethyloxan-2-yl]-3-hydroxypentan-2-yl]-20-hydroxy-9-methoxy-1,3,13-trimethyl-16-pentyl-7,17,19-trioxabicyclo[13.4.1]icosa-2,4,10,12-tetraen-6-one, (1S,3E,5E,7S,8R,11E,13E,15S,19S,20S)-8-[(1S,2R,3S)-3-[(2R,4R,5R,6R)-4-[(2R,4R,5S,6R)-4,5-dihydroxy-6-methyl-tetrahydropyran-2-yl]oxy-2-hydroxy-5,6-dimethyl-tetrahydropyran-2-yl]-2-hydroxy-1-methyl-butyl]-20-hydroxy-7-methoxy-3,13,15-trimethyl-19-pentyl-9,16,18-trioxabicyclo[13.4.1]icosa-3,5,11,13-tetraen-10-one, 8-{3-[4-(4,5-Dihydroxy-6-methyl-tetrahydro-pyran-2-yloxy)-2-hydroxy-5,6-dimethyl-tetrahydro-pyran-2-yl]-2-hydroxy-1-methyl-butyl}-20-hydroxy-9-methoxy-1,3,13-trimethyl-16-pentyl-7,17,19-trioxa-bicyclo[13.4.1]icosa-2,4,10,12-tetraen-6-one, (1S,2E,4E,8R,9S,10E,12E,15S,16S,20S)-8-((2S,3R,4S)-4-((2R,4R,5R,6R)-4-((2R,4R,5S,6R)-4,5-dihydroxy-6-methyloxan-2-yl)oxy-2-hydroxy-5,6-dimethyloxan-2-yl)-3-hydroxypentan-2-yl)-20-hydroxy-9-methoxy-1,3,13-trimethyl-16-pentyl-7,17,19-trioxabicyclo(13.4.1)icosa-2,4,10,12-tetraen-6-one
| Molecular Formula | C44H72O13 |
|---|---|
| Molecular Weight | 808.50 g/mol |
| LogP | 5.0194 |
| Topological Polar Surface Area | 182.83 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 11 |
| Exact Mass | 808.4973 |
| Heavy Atoms | 57 |
| Complexity | 1401.8455 |
Chemical Identifiers
| CAS Number | 200497-99-0 |
|---|---|
| SMILES | CCCCC[C@H]1[C@H]2C/C(=C/C=C/[C@@H]([C@H](OC(=O)/C=C/C(=C/[C@@]([C@H]2O)(OCO1)C)/C)[C@@H](C)[C@H]([C@H](C)[C@]3(C[C@H]([C@@H]([C@H](O3)C)C)O[C@H]4C[C@H]([C@@H]([C@H](O4)C)O)O)O)O)OC)/C |
Product Overview
Formamicin (CAS 200497-99-0), with molecular formula C44H72O13 and molecular weight 808.50 g/mol. IUPAC: (1S,2E,4E,8R,9S,10E,12E,15S,16S,20S)-8-[(2S,3R,4S)-4-[(2R,4R,5R,6R)-4-[(2R,4R,5S,6R)-4,5-dihydroxy-6-methyloxan-2-yl]oxy-2-hydroxy-5,6-dimethyloxan-2-yl]-3-hydroxypentan-2-yl]-20-hydroxy-9-methoxy-1,3,13-trimethyl-16-pentyl-7,17,19-trioxabicyclo[13.4.1]icosa-2,4,10,12-tetraen-6-one.
Chemical Property Profile of Formamicin
Property Insights of Formamicin
The XLogP value of 5.0194 indicates that Formamicin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 182.83 Ų indicates high polarity, suggesting Formamicin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Formamicin has 5 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Formamicin?
The CAS number of Formamicin is 200497-99-0.
What is the molecular formula of Formamicin?
The molecular formula of Formamicin is C44H72O13.
What is the molecular weight of Formamicin?
The molecular weight of Formamicin is 808.50 g/mol.
Where can I buy Formamicin?
You can request a quote for Formamicin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Formamicin?
Yes, KEHONG BIO provides custom synthesis services for Formamicin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.