Novel trichothecene
TL;DR: Novel trichothecene (CAS 53126-64-0) is a chemical compound with molecular formula C29H36O9 and molecular weight 528.24 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1Z,19Z,21Z)-27-hydroxy-23-(1-hydroxyethyl)-9,15-dimethylspiro[4,12,17,24-tetraoxapentacyclo[21.3.1.113,16.06,11.06,15]octacosa-1,9,19,21-tetraene-14,2'-oxirane]-3,18-dione
Also Known As: Satratoxin H, isosatratoxin H, NOVEL TRICHOTHECENE, Satratoxin H, stereoisomer, Antibiotic PD-113326
| Molecular Formula | C29H36O9 |
|---|---|
| Molecular Weight | 528.24 g/mol |
| LogP | 2.0675 |
| Topological Polar Surface Area | 124.05 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 9 |
| Rotatable Bonds | 1 |
| Exact Mass | 528.23596 |
| Heavy Atoms | 38 |
| Complexity | 1146.691 |
Chemical Identifiers
| CAS Number | 53126-64-0 |
|---|---|
| SMILES | CC1=CC2C3(CC1)COC(=O)/C=C\4/CCOC(C4O)(/C=C\C=C/C(=O)OC5C3(C6(CO6)C(C5)O2)C)C(C)O |
Product Overview
Novel trichothecene (CAS 53126-64-0), with molecular formula C29H36O9 and molecular weight 528.24 g/mol. IUPAC: (1Z,19Z,21Z)-27-hydroxy-23-(1-hydroxyethyl)-9,15-dimethylspiro[4,12,17,24-tetraoxapentacyclo[21.3.1.113,16.06,11.06,15]octacosa-1,9,19,21-tetraene-14,2'-oxirane]-3,18-dione.
Chemical Property Profile of Novel trichothecene
Property Insights of Novel trichothecene
The XLogP value of 2.0675 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Novel trichothecene. The TPSA of 124.05 Ų falls within the moderate polarity range, balancing permeability and solubility for Novel trichothecene. Following Lipinski's Rule of Five, Novel trichothecene has 2 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 Novel trichothecene?
The CAS number of Novel trichothecene is 53126-64-0.
What is the molecular formula of Novel trichothecene?
The molecular formula of Novel trichothecene is C29H36O9.
What is the molecular weight of Novel trichothecene?
The molecular weight of Novel trichothecene is 528.24 g/mol.
Where can I buy Novel trichothecene?
You can request a quote for Novel trichothecene directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Novel trichothecene?
Yes, KEHONG BIO provides custom synthesis services for Novel trichothecene and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.