3,3a-二脱氢石蒜碱-1α,2β-二醇
TL;DR: 3,3a-二脱氢石蒜碱-1α,2β-二醇 (CAS 476-28-8) is a chemical compound with molecular formula C16H17NO4 and molecular weight 287.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3,3a-二脱氢石蒜碱-1α,2β-二醇
5,7-dioxa-12-azapentacyclo[10.6.1.02,10.04,8.015,19]nonadeca-2,4(8),9,15-tetraene-17,18-diol
Also Known As: lycorine, Amarylline, Galanthidine, Narcissine, Licorine
| Molecular Formula | C16H17NO4 |
|---|---|
| Molecular Weight | 287.12 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 62.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 0 |
| Exact Mass | 287.11575 |
| Heavy Atoms | 21 |
| Complexity | 481.0 |
Chemical Identifiers
| CAS Number | 476-28-8 |
|---|---|
| SMILES | C1CN2CC3=CC4=C(C=C3C5C2C1=CC(C5O)O)OCO4 |
| InChIKey | XGVJWXAYKUHDOO-UHFFFAOYSA-N |
Product Overview
3,3a-二脱氢石蒜碱-1α,2β-二醇 (CAS 476-28-8), with molecular formula C16H17NO4 and molecular weight 287.12 g/mol. IUPAC: 5,7-dioxa-12-azapentacyclo[10.6.1.02,10.04,8.015,19]nonadeca-2,4(8),9,15-tetraene-17,18-diol.
Chemical Property Profile of 3,3a-二脱氢石蒜碱-1α,2β-二醇
Property Insights of 3,3a-二脱氢石蒜碱-1α,2β-二醇
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,3a-二脱氢石蒜碱-1α,2β-二醇. The TPSA of 62.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,3a-二脱氢石蒜碱-1α,2β-二醇. Following Lipinski's Rule of Five, 3,3a-二脱氢石蒜碱-1α,2β-二醇 has 2 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 3,3a-二脱氢石蒜碱-1α,2β-二醇?
The CAS number of 3,3a-二脱氢石蒜碱-1α,2β-二醇 is 476-28-8.
What is the molecular formula of 3,3a-二脱氢石蒜碱-1α,2β-二醇?
The molecular formula of 3,3a-二脱氢石蒜碱-1α,2β-二醇 is C16H17NO4.
What is the molecular weight of 3,3a-二脱氢石蒜碱-1α,2β-二醇?
The molecular weight of 3,3a-二脱氢石蒜碱-1α,2β-二醇 is 287.12 g/mol.
Where can I buy 3,3a-二脱氢石蒜碱-1α,2β-二醇?
You can request a quote for 3,3a-二脱氢石蒜碱-1α,2β-二醇 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3,3a-二脱氢石蒜碱-1α,2β-二醇?
Yes, KEHONG BIO provides custom synthesis services for 3,3a-二脱氢石蒜碱-1α,2β-二醇 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.