垂盆草苷
TL;DR: 垂盆草苷 (CAS 71933-54-5) is a chemical compound with molecular formula C11H17NO7 and molecular weight 275.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
垂盆草苷
2-(hydroxymethyl)-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybut-2-enenitrile
Also Known As: Sarmentosin
| Molecular Formula | C11H17NO7 |
|---|---|
| Molecular Weight | 275.10 g/mol |
| LogP | -3.1 |
| Topological Polar Surface Area | 143.0 Ų |
| Hydrogen Bond Donors | 5 |
| Hydrogen Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Exact Mass | 275.1005 |
| Heavy Atoms | 19 |
| Complexity | 363.0 |
Chemical Identifiers
| CAS Number | 71933-54-5 |
|---|---|
| SMILES | C(C=C(CO)C#N)O[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O)O)O |
| InChIKey | FWAYDNJCBHNWQD-KAMPLNKDSA-N |
Product Overview
垂盆草苷 (CAS 71933-54-5), with molecular formula C11H17NO7 and molecular weight 275.10 g/mol. IUPAC: 2-(hydroxymethyl)-4-[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxybut-2-enenitrile.
Chemical Property Profile of 垂盆草苷
Property Insights of 垂盆草苷
The XLogP value of -3.1 indicates that 垂盆草苷 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 143.0 Ų indicates high polarity, suggesting 垂盆草苷 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, 垂盆草苷 has 5 hydrogen bond donor(s) and 8 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 垂盆草苷?
The CAS number of 垂盆草苷 is 71933-54-5.
What is the molecular formula of 垂盆草苷?
The molecular formula of 垂盆草苷 is C11H17NO7.
What is the molecular weight of 垂盆草苷?
The molecular weight of 垂盆草苷 is 275.10 g/mol.
Where can I buy 垂盆草苷?
You can request a quote for 垂盆草苷 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 垂盆草苷?
Yes, KEHONG BIO provides custom synthesis services for 垂盆草苷 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.