N-(3alpha-Hydroxylup-20(29)-en-28-oyl)-11-aminoundecanoic acid
TL;DR: N-(3alpha-Hydroxylup-20(29)-en-28-oyl)-11-aminoundecanoic acid (CAS 150840-32-7) is a chemical compound with molecular formula C41H69NO4 and molecular weight 639.52264 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
11-[[(1R,3aS,5aR,5bR,7aR,9R,11aR,11bR,13aR,13bR)-9-hydroxy-5a,5b,8,8,11a-pentamethyl-1-prop-1-en-2-yl-1,2,3,4,5,6,7,7a,9,10,11,11b,12,13,13a,13b-hexadecahydrocyclopenta[a]chrysene-3a-carbonyl]amino]undecanoic acid
Also Known As: Lupane, undecanoic acid deriv., Betulinic acid, 11-aminoundecanoate deriv., 3aH-Cyclopenta[a]chrysene, undecanoic acid deriv., N-(3alpha-Hydroxylup-20(29)-en-28-oyl)-11-aminoundecanoic acid, N-[3.alpha.-Hydroxylup-20(29)-en-28-oyl]-11-aminoundecanoic acid
Technical Specifications
| Molecular Formula | C41H69NO4 |
| Molecular Weight | 639.52264 g/mol |
| XLogP | 11.2 |
| Topological Polar Surface Area (TPSA) | 86.6 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 13 |
| Exact Mass | 639.52264 Da |
| Heavy Atoms | 46 |
| Complexity | 1130.0 |
| SMILES | CC(=C)[C@@H]1CC[C@]2([C@H]1[C@H]3CC[C@@H]4[C@]5(CC[C@H](C([C@@H]5CC[C@]4([C@@]3(CC2)C)C)(C)C)O)C)C(=O)NCCCCCCCCCCC(=O)O |
| InChIKey | RIKPHTJUWKAFML-NSFVVYLKSA-N |
Chemical Property Profile of N-(3alpha-Hydroxylup-20(29)-en-28-oyl)-11-aminoundecanoic acid
Property Insights of N-(3alpha-Hydroxylup-20(29)-en-28-oyl)-11-aminoundecanoic acid
The XLogP value of 11.2 indicates that N-(3alpha-Hydroxylup-20(29)-en-28-oyl)-11-aminoundecanoic acid is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 86.6 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(3alpha-Hydroxylup-20(29)-en-28-oyl)-11-aminoundecanoic acid. Following Lipinski's Rule of Five, N-(3alpha-Hydroxylup-20(29)-en-28-oyl)-11-aminoundecanoic acid has 3 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of N-(3alpha-Hydroxylup-20(29)-en-28-oyl)-11-aminoundecanoic acid?
The CAS number of N-(3alpha-Hydroxylup-20(29)-en-28-oyl)-11-aminoundecanoic acid is 150840-32-7.
What is the molecular formula of N-(3alpha-Hydroxylup-20(29)-en-28-oyl)-11-aminoundecanoic acid?
The molecular formula of N-(3alpha-Hydroxylup-20(29)-en-28-oyl)-11-aminoundecanoic acid is C41H69NO4.
What is the molecular weight of N-(3alpha-Hydroxylup-20(29)-en-28-oyl)-11-aminoundecanoic acid?
The molecular weight of N-(3alpha-Hydroxylup-20(29)-en-28-oyl)-11-aminoundecanoic acid is 639.52264 g/mol.
Where can I buy N-(3alpha-Hydroxylup-20(29)-en-28-oyl)-11-aminoundecanoic acid?
You can request a quote for N-(3alpha-Hydroxylup-20(29)-en-28-oyl)-11-aminoundecanoic acid directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-(3alpha-Hydroxylup-20(29)-en-28-oyl)-11-aminoundecanoic acid?
Yes, CoreyChem provides custom synthesis services for N-(3alpha-Hydroxylup-20(29)-en-28-oyl)-11-aminoundecanoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.