管绫扇花碱
TL;DR: 管绫扇花碱 (CAS 2632-29-3) is a chemical compound with molecular formula C29H37N3O3 and molecular weight 475.28 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
管绫扇花碱
(1R)-1-[[(2S,3R,11bS)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]methyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-6-ol
Also Known As: Tubulosine, Marckine, Indole alkaloid, 10,11-Dimethoxytubulosanol, Tubulosan-8'-ol, 10,11-dimethoxy-
| Molecular Formula | C29H37N3O3 |
|---|---|
| Molecular Weight | 475.28 g/mol |
| LogP | 4.6 |
| Topological Polar Surface Area | 69.8 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 475.28348 |
| Heavy Atoms | 35 |
| Complexity | 723.0 |
Chemical Identifiers
| CAS Number | 2632-29-3 |
|---|---|
| SMILES | CC[C@H]1CN2CCC3=CC(=C(C=C3[C@@H]2C[C@@H]1C[C@@H]4C5=C(CCN4)C6=C(N5)C=CC(=C6)O)OC)OC |
| InChIKey | JRVWIILYWSBUMC-PRUVNFMMSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
管绫扇花碱 (CAS 2632-29-3), with molecular formula C29H37N3O3 and molecular weight 475.28 g/mol. IUPAC: (1R)-1-[[(2S,3R,11bS)-3-ethyl-9,10-dimethoxy-2,3,4,6,7,11b-hexahydro-1H-benzo[a]quinolizin-2-yl]methyl]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-6-ol.
Chemical Property Profile of 管绫扇花碱
Property Insights of 管绫扇花碱
The XLogP value of 4.6 indicates that 管绫扇花碱 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 69.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 管绫扇花碱. Following Lipinski's Rule of Five, 管绫扇花碱 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 管绫扇花碱?
The CAS number of 管绫扇花碱 is 2632-29-3.
What is the molecular formula of 管绫扇花碱?
The molecular formula of 管绫扇花碱 is C29H37N3O3.
What is the molecular weight of 管绫扇花碱?
The molecular weight of 管绫扇花碱 is 475.28 g/mol.
Where can I buy 管绫扇花碱?
You can request a quote for 管绫扇花碱 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 管绫扇花碱?
Yes, KEHONG BIO provides custom synthesis services for 管绫扇花碱 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.