Neoantimycin
TL;DR: Neoantimycin (CAS 22862-63-1) is a chemical compound with molecular formula C36H46N2O12 and molecular weight 698.31 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(15-benzyl-10-butan-2-yl-14-hydroxy-7,13,13-trimethyl-2,5,9,12-tetraoxo-3-propan-2-yl-1,4,8,11-tetraoxacyclopentadec-6-yl)-3-formamido-2-hydroxybenzamide
Also Known As: Neoantimycin, N-(15-benzyl-10-butan-2-yl-14-hydroxy-7,13,13-trimethyl-2,5,9,12-tetraoxo-3-propan-2-yl-1,4,8,11-tetraoxacyclopentadec-6-yl)-3-formamido-2-hydroxybenzamide, Salicylamide, N-(15-benzyl-10-sec-butyl-14-hydroxy-3-isopropyl-7,13,13-trimethyl-2,5,9,12-tetraoxo-1,4,8,11-tetraoxacyclopentadec-6-yl)-3-formamido-, Benzamide, 3-(formylamino)-2-hydroxy-N-[14-hydroxy-7,13,13-trimethyl-3-(1-methylethyl)-10-(1-methylpropyl)-2,5,9,12-tetraoxo-15-(phenylmethyl)-1,4,8,11-tetraoxacyclopentadec-6-yl]-, N-[(3S,6S,7R,10R,14S,15S)-15-Benzyl-10-[(2S)-butan-2-yl]-14-hydroxy-7,13,13-trimethyl-2,5,9,12-tetraoxo-3-propan-2-yl-1,4,8,11-tetraoxacyclopentadec-6-yl]-3-formamido-2-hydroxybenzamide
| Molecular Formula | C36H46N2O12 |
|---|---|
| Molecular Weight | 698.31 g/mol |
| LogP | 5.8 |
| Topological Polar Surface Area | 204.0 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 8 |
| Exact Mass | 698.30505 |
| Heavy Atoms | 50 |
| Complexity | 1200.0 |
Chemical Identifiers
| CAS Number | 22862-63-1 |
|---|---|
| SMILES | CCC(C)C1C(=O)OC(C(C(=O)OC(C(=O)OC(C(C(C(=O)O1)(C)C)O)CC2=CC=CC=C2)C(C)C)NC(=O)C3=C(C(=CC=C3)NC=O)O)C |
| InChIKey | JIJATTFJYJZEBT-UHFFFAOYSA-N |
Product Overview
Neoantimycin (CAS 22862-63-1), with molecular formula C36H46N2O12 and molecular weight 698.31 g/mol. IUPAC: N-(15-benzyl-10-butan-2-yl-14-hydroxy-7,13,13-trimethyl-2,5,9,12-tetraoxo-3-propan-2-yl-1,4,8,11-tetraoxacyclopentadec-6-yl)-3-formamido-2-hydroxybenzamide.
Chemical Property Profile of Neoantimycin
Property Insights of Neoantimycin
The XLogP value of 5.8 indicates that Neoantimycin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 204.0 Ų indicates high polarity, suggesting Neoantimycin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Neoantimycin has 4 hydrogen bond donor(s) and 12 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Neoantimycin?
The CAS number of Neoantimycin is 22862-63-1.
What is the molecular formula of Neoantimycin?
The molecular formula of Neoantimycin is C36H46N2O12.
What is the molecular weight of Neoantimycin?
The molecular weight of Neoantimycin is 698.31 g/mol.
Where can I buy Neoantimycin?
You can request a quote for Neoantimycin directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Neoantimycin?
Yes, KEHONG BIO provides custom synthesis services for Neoantimycin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.