环杷明
TL;DR: 环杷明 (CAS 4449-51-8) is a chemical compound with molecular formula C27H41NO2 and molecular weight 411.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
环杷明
3',6',10,11b-tetramethylspiro[2,3,4,6,6a,6b,7,8,11,11a-decahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-ol
Also Known As: CYCLOPAMINE, 11-Deoxojervine, 11-Deoxyjervine, cyclopamine [M+H]+, 17,23-Epoxyveratraman-3-ol
| Molecular Formula | C27H41NO2 |
|---|---|
| Molecular Weight | 411.31 g/mol |
| LogP | 5.0019 |
| Topological Polar Surface Area | 41.49 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 0 |
| Exact Mass | 411.31372 |
| Heavy Atoms | 30 |
| Complexity | 800.68475 |
Chemical Identifiers
| CAS Number | 4449-51-8 |
|---|---|
| SMILES | CC1CC2C(C(C3(O2)CCC4C5CC=C6CC(CCC6(C5CC4=C3C)C)O)C)NC1 |
Product Overview
环杷明 (CAS 4449-51-8), with molecular formula C27H41NO2 and molecular weight 411.31 g/mol. IUPAC: 3',6',10,11b-tetramethylspiro[2,3,4,6,6a,6b,7,8,11,11a-decahydro-1H-benzo[a]fluorene-9,2'-3a,4,5,6,7,7a-hexahydro-3H-furo[3,2-b]pyridine]-3-ol.
Chemical Property Profile of 环杷明
Property Insights of 环杷明
The XLogP value of 5.0019 indicates that 环杷明 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.49 Ų, 环杷明 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 环杷明 has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of 环杷明?
The CAS number of 环杷明 is 4449-51-8.
What is the molecular formula of 环杷明?
The molecular formula of 环杷明 is C27H41NO2.
What is the molecular weight of 环杷明?
The molecular weight of 环杷明 is 411.31 g/mol.
Where can I buy 环杷明?
You can request a quote for 环杷明 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 环杷明?
Yes, KEHONG BIO provides custom synthesis services for 环杷明 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.