鹅膏蕈氨酸
TL;DR: 鹅膏蕈氨酸 (CAS 2552-55-8) is a chemical compound with molecular formula C5H6N2O4 and molecular weight 158.03 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
鹅膏蕈氨酸
2-amino-2-(3-oxo-1,2-oxazol-5-yl)acetic acid
Also Known As: Ibotenic acid, Ibotenate, Amanita muscaria, DL-Ibotenic acid, (+/-)-Ibotenic acid
| Molecular Formula | C5H6N2O4 |
|---|---|
| Molecular Weight | 158.03 g/mol |
| LogP | -3.9 |
| Topological Polar Surface Area | 102.0 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Exact Mass | 158.03276 |
| Heavy Atoms | 11 |
| Complexity | 235.0 |
Chemical Identifiers
| CAS Number | 2552-55-8 |
|---|---|
| SMILES | C1=C(ONC1=O)C(C(=O)O)N |
| InChIKey | IRJCBFDCFXCWGO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
鹅膏蕈氨酸 (CAS 2552-55-8), with molecular formula C5H6N2O4 and molecular weight 158.03 g/mol. IUPAC: 2-amino-2-(3-oxo-1,2-oxazol-5-yl)acetic acid.
Chemical Property Profile of 鹅膏蕈氨酸
Property Insights of 鹅膏蕈氨酸
The XLogP value of -3.9 indicates that 鹅膏蕈氨酸 is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. The TPSA of 102.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 鹅膏蕈氨酸. Following Lipinski's Rule of Five, 鹅膏蕈氨酸 has 3 hydrogen bond donor(s) and 5 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 鹅膏蕈氨酸?
The CAS number of 鹅膏蕈氨酸 is 2552-55-8.
What is the molecular formula of 鹅膏蕈氨酸?
The molecular formula of 鹅膏蕈氨酸 is C5H6N2O4.
What is the molecular weight of 鹅膏蕈氨酸?
The molecular weight of 鹅膏蕈氨酸 is 158.03 g/mol.
Where can I buy 鹅膏蕈氨酸?
You can request a quote for 鹅膏蕈氨酸 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 鹅膏蕈氨酸?
Yes, KEHONG BIO provides custom synthesis services for 鹅膏蕈氨酸 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.