Stevastelin B3
TL;DR: Stevastelin B3 (CAS 147334-90-5) is a chemical compound with molecular formula C34H61N3O9 and molecular weight 655.44 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2R,3R,4S,5R)-3,5-dihydroxy-2,4-dimethyloctadecanoyl]amino]-3,3-dimethylpent-4-enoyl]amino]-3-hydroxybutanoyl]amino]-3-oxopropanoic acid
Also Known As: Stevastelin B3, Stevastelin B 3, Stevastelin B, Antibiotic NK 374186B3, NK 374186B3
| Molecular Formula | C34H61N3O9 |
|---|---|
| Molecular Weight | 655.44 g/mol |
| LogP | 6.1 |
| Topological Polar Surface Area | 202.0 Ų |
| Hydrogen Bond Donors | 7 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 26 |
| Exact Mass | 655.4408 |
| Heavy Atoms | 46 |
| Complexity | 958.0 |
Chemical Identifiers
| CAS Number | 147334-90-5 |
|---|---|
| SMILES | CCCCCCCCCCCCC[C@H]([C@H](C)[C@H]([C@@H](C)C(=O)N[C@H](C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C=O)C(=O)O)C(C)(C)C=C)O)O |
| InChIKey | HIRFPWCSYAMYPE-RYUAEMIRSA-N |
Product Overview
Stevastelin B3 (CAS 147334-90-5), with molecular formula C34H61N3O9 and molecular weight 655.44 g/mol. IUPAC: (2S)-2-[[(2S,3R)-2-[[(2S)-2-[[(2R,3R,4S,5R)-3,5-dihydroxy-2,4-dimethyloctadecanoyl]amino]-3,3-dimethylpent-4-enoyl]amino]-3-hydroxybutanoyl]amino]-3-oxopropanoic acid.
Chemical Property Profile of Stevastelin B3
Property Insights of Stevastelin B3
The XLogP value of 6.1 indicates that Stevastelin B3 is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 202.0 Ų indicates high polarity, suggesting Stevastelin B3 may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Stevastelin B3 has 7 hydrogen bond donor(s) and 9 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Stevastelin B3?
The CAS number of Stevastelin B3 is 147334-90-5.
What is the molecular formula of Stevastelin B3?
The molecular formula of Stevastelin B3 is C34H61N3O9.
What is the molecular weight of Stevastelin B3?
The molecular weight of Stevastelin B3 is 655.44 g/mol.
Where can I buy Stevastelin B3?
You can request a quote for Stevastelin B3 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Stevastelin B3?
Yes, KEHONG BIO provides custom synthesis services for Stevastelin B3 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.