6-Hydroxy-methyl 1'-epiacarviosin
TL;DR: 6-Hydroxy-methyl 1'-epiacarviosin (CAS 101144-38-1) is a chemical compound with molecular formula C14H25NO9 and molecular weight 351.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1S,2S,3R,6R)-6-[[(2S,3S,4S,5R,6S)-4,5-dihydroxy-2-(hydroxymethyl)-6-methoxyoxan-3-yl]amino]-4-(hydroxymethyl)cyclohex-4-ene-1,2,3-triol
Also Known As: 6-Hmecv, 6-Hydroxy-methyl 1'-epiacarviosin, 6-Hydroxy-methyl 1/'-epiacarviosin, (1S,2S,3R,6R)-6-[[(2S,3S,4S,5R,6S)-4,5-dihydroxy-2-(hydroxymethyl)-6-methoxyoxan-3-yl]amino]-4-(hydroxymethyl)cyclohex-4-ene-1,2,3-triol, Cyclopentaneoctanoic acid, 3-oxo-2-(2Z)-2-pentenyl-, (1S,2R)-
| Molecular Formula | C14H25NO9 |
|---|---|
| Molecular Weight | 351.15 g/mol |
| LogP | -4.2 |
| Topological Polar Surface Area | 172.0 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 10 |
| Rotatable Bonds | 5 |
| Exact Mass | 351.15292 |
| Heavy Atoms | 24 |
| Complexity | 448.0 |
Chemical Identifiers
| CAS Number | 101144-38-1 |
|---|---|
| SMILES | CO[C@@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)N[C@@H]2C=C([C@H]([C@@H]([C@H]2O)O)O)CO)O)O |
| InChIKey | UQSNMDDZJRJJQN-PEQZYJMFSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-Hydroxy-methyl 1'-epiacarviosin (CAS 101144-38-1), with molecular formula C14H25NO9 and molecular weight 351.15 g/mol. IUPAC: (1S,2S,3R,6R)-6-[[(2S,3S,4S,5R,6S)-4,5-dihydroxy-2-(hydroxymethyl)-6-methoxyoxan-3-yl]amino]-4-(hydroxymethyl)cyclohex-4-ene-1,2,3-triol.
Chemical Property Profile of 6-Hydroxy-methyl 1'-epiacarviosin
Property Insights of 6-Hydroxy-methyl 1'-epiacarviosin
The XLogP value of -4.2 indicates that 6-Hydroxy-methyl 1'-epiacarviosin is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 172.0 Ų indicates high polarity, suggesting 6-Hydroxy-methyl 1'-epiacarviosin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 6-Hydroxy-methyl 1'-epiacarviosin has 8 hydrogen bond donor(s) and 10 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 6-Hydroxy-methyl 1'-epiacarviosin?
The CAS number of 6-Hydroxy-methyl 1'-epiacarviosin is 101144-38-1.
What is the molecular formula of 6-Hydroxy-methyl 1'-epiacarviosin?
The molecular formula of 6-Hydroxy-methyl 1'-epiacarviosin is C14H25NO9.
What is the molecular weight of 6-Hydroxy-methyl 1'-epiacarviosin?
The molecular weight of 6-Hydroxy-methyl 1'-epiacarviosin is 351.15 g/mol.
Where can I buy 6-Hydroxy-methyl 1'-epiacarviosin?
You can request a quote for 6-Hydroxy-methyl 1'-epiacarviosin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Hydroxy-methyl 1'-epiacarviosin?
Yes, KEHONG BIO provides custom synthesis services for 6-Hydroxy-methyl 1'-epiacarviosin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.