Lokysterolamine A
TL;DR: Lokysterolamine A (CAS 159934-14-2) is a chemical compound with molecular formula C31H50N2O and molecular weight 466.39 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
Lokysterolamine A
(3S,4R,5R,9R,10R,13R,14R,17R)-3-(dimethylamino)-10,13-dimethyl-17-[(2R)-1-(4-propan-2-ylidene-2,3-dihydropyrrol-5-yl)propan-2-yl]-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-4-ol
Also Known As: Lokysterolamine A, N,N-Dimethylplakinamine A, (3S,4R,5R,9R,10R,13R,14R,17R)-3-(dimethylamino)-10,13-dimethyl-17-[(2R)-1-(4-propan-2-ylidene-2,3-dihydropyrrol-5-yl)propan-2-yl]-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-4-ol, (3S,4R,5R,9R,10R,13R,14R,17R)-3-(dimethylamino)-10,13-dimethyl-17-((R)-1-(4-(propan-2-ylidene)-3,4-dihydro-2H-pyrrol-5-yl)propan-2-yl)-2,3,4,5,6,9,10,11,12,13,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-4-ol, Pregn-7-en-4-ol, 21-(3,4-dihydro-4-(1-methylethylidene)-2H-pyrrol-5-yl)-3-(dimethylamino)-20-methyl-, (3beta,4beta,5alpha,20R)-
| Molecular Formula | C31H50N2O |
|---|---|
| Molecular Weight | 466.39 g/mol |
| LogP | 6.2 |
| Topological Polar Surface Area | 35.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 466.3923 |
| Heavy Atoms | 34 |
| Complexity | 895.0 |
Chemical Identifiers
| CAS Number | 159934-14-2 |
|---|---|
| SMILES | C[C@H](CC1=NCCC1=C(C)C)[C@H]2CC[C@@H]3[C@@]2(CC[C@H]4C3=CC[C@@H]5[C@@]4(CC[C@@H]([C@@H]5O)N(C)C)C)C |
| InChIKey | VIMZHTFJEDRKBC-GQYVRWDISA-N |
Product Overview
Lokysterolamine A (CAS 159934-14-2), with molecular formula C31H50N2O and molecular weight 466.39 g/mol. IUPAC: (3S,4R,5R,9R,10R,13R,14R,17R)-3-(dimethylamino)-10,13-dimethyl-17-[(2R)-1-(4-propan-2-ylidene-2,3-dihydropyrrol-5-yl)propan-2-yl]-2,3,4,5,6,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-4-ol.
Chemical Property Profile of Lokysterolamine A
Property Insights of Lokysterolamine A
The XLogP value of 6.2 indicates that Lokysterolamine A is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 35.8 Ų, Lokysterolamine A exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Lokysterolamine A has 1 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 Lokysterolamine A?
The CAS number of Lokysterolamine A is 159934-14-2.
What is the molecular formula of Lokysterolamine A?
The molecular formula of Lokysterolamine A is C31H50N2O.
What is the molecular weight of Lokysterolamine A?
The molecular weight of Lokysterolamine A is 466.39 g/mol.
Where can I buy Lokysterolamine A?
You can request a quote for Lokysterolamine A directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Lokysterolamine A?
Yes, KEHONG BIO provides custom synthesis services for Lokysterolamine A and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.