Janthinocin C
TL;DR: Janthinocin C (CAS 131086-54-9) is a chemical compound with molecular formula C57H82N12O15 and molecular weight 1174.60 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-N-[6-(3-aminopropyl)-3-benzyl-15-ethylidene-24-(1-hydroxyethyl)-12,21-bis(hydroxymethyl)-18-(1-hydroxy-2-methylpropyl)-9-(1H-indol-3-ylmethylidene)-2,5,8,11,14,17,20,23,26-nonaoxo-28-propan-2-yl-1-oxa-4,7,10,13,16,19,22,25-octazacyclooctacos-27-yl]-3-methylpentanamide
Also Known As: Janthinocin C
| Molecular Formula | C57H82N12O15 |
|---|---|
| Molecular Weight | 1174.60 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 437.0 Ų |
| Hydrogen Bond Donors | 16 |
| Hydrogen Bond Acceptors | 17 |
| Rotatable Bonds | 16 |
| Exact Mass | 1174.6023 |
| Heavy Atoms | 84 |
| Complexity | 2350.0 |
Chemical Identifiers
| CAS Number | 131086-54-9 |
|---|---|
| SMILES | CCC(C)C(C(=O)NC1C(OC(=O)C(NC(=O)C(NC(=O)C(=CC2=CNC3=CC=CC=C32)NC(=O)C(NC(=O)C(=CC)NC(=O)C(NC(=O)C(NC(=O)C(NC1=O)C(C)O)CO)C(C(C)C)O)CO)CCCN)CC4=CC=CC=C4)C(C)C)N |
| InChIKey | BRHKGQIVZZCHPV-UHFFFAOYSA-N |
Product Overview
Janthinocin C (CAS 131086-54-9), with molecular formula C57H82N12O15 and molecular weight 1174.60 g/mol. IUPAC: 2-amino-N-[6-(3-aminopropyl)-3-benzyl-15-ethylidene-24-(1-hydroxyethyl)-12,21-bis(hydroxymethyl)-18-(1-hydroxy-2-methylpropyl)-9-(1H-indol-3-ylmethylidene)-2,5,8,11,14,17,20,23,26-nonaoxo-28-propan-2-yl-1-oxa-4,7,10,13,16,19,22,25-octazacyclooctacos-27-yl]-3-methylpentanamide.
Chemical Property Profile of Janthinocin C
Property Insights of Janthinocin C
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Janthinocin C. The TPSA of 437.0 Ų indicates high polarity, suggesting Janthinocin C may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Janthinocin C has 16 hydrogen bond donor(s) and 17 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Janthinocin C?
The CAS number of Janthinocin C is 131086-54-9.
What is the molecular formula of Janthinocin C?
The molecular formula of Janthinocin C is C57H82N12O15.
What is the molecular weight of Janthinocin C?
The molecular weight of Janthinocin C is 1174.60 g/mol.
Where can I buy Janthinocin C?
You can request a quote for Janthinocin C directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Janthinocin C?
Yes, KEHONG BIO provides custom synthesis services for Janthinocin C and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.