10-Hydroxyusambarine
TL;DR: 10-Hydroxyusambarine (CAS 42814-43-7) is a chemical compound with molecular formula C30H34N4O and molecular weight 466.27 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,3R,12bS)-3-ethenyl-2-[[(1S)-2-methyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-1-yl]methyl]-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-9-ol
Also Known As: Usambaridine Vi, 10-Hydroxyusambarine, Usambaridine (Violet), 4-Guanidinobenzoic acid hydrochloride, J1.162.149J
| Molecular Formula | C30H34N4O |
|---|---|
| Molecular Weight | 466.27 g/mol |
| LogP | 5.6954 |
| Topological Polar Surface Area | 58.29 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 466.27325 |
| Heavy Atoms | 35 |
| Complexity | 1431.18 |
Chemical Identifiers
| CAS Number | 42814-43-7 |
|---|---|
| SMILES | CN1CCC2=C([C@@H]1C[C@H]3C[C@H]4C5=C(CCN4C[C@@H]3C=C)C6=C(N5)C=CC(=C6)O)NC7=CC=CC=C27 |
Product Overview
10-Hydroxyusambarine (CAS 42814-43-7), with molecular formula C30H34N4O and molecular weight 466.27 g/mol. IUPAC: (2S,3R,12bS)-3-ethenyl-2-[[(1S)-2-methyl-1,3,4,9-tetrahydropyrido[3,4-b]indol-1-yl]methyl]-1,2,3,4,6,7,12,12b-octahydroindolo[2,3-a]quinolizin-9-ol.
Chemical Property Profile of 10-Hydroxyusambarine
Property Insights of 10-Hydroxyusambarine
The XLogP value of 5.6954 indicates that 10-Hydroxyusambarine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 58.29 Ų, 10-Hydroxyusambarine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 10-Hydroxyusambarine has 3 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 10-Hydroxyusambarine?
The CAS number of 10-Hydroxyusambarine is 42814-43-7.
What is the molecular formula of 10-Hydroxyusambarine?
The molecular formula of 10-Hydroxyusambarine is C30H34N4O.
What is the molecular weight of 10-Hydroxyusambarine?
The molecular weight of 10-Hydroxyusambarine is 466.27 g/mol.
Where can I buy 10-Hydroxyusambarine?
You can request a quote for 10-Hydroxyusambarine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 10-Hydroxyusambarine?
Yes, KEHONG BIO provides custom synthesis services for 10-Hydroxyusambarine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.