Tolytoxin
TL;DR: Tolytoxin (CAS 127999-44-4) is a chemical compound with molecular formula C46H75NO13 and molecular weight 849.52386 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(E,3R,4R,5R,9S,10S,11S)-10-hydroxy-11-[(1S,3S,4S,5S,7R,8S,9R,12E,14E,16S,17R,19R)-16-hydroxy-3,5,7,17-tetramethoxy-8,14-dimethyl-11-oxospiro[10,23-dioxabicyclo[17.3.1]tricosa-12,14,20-triene-4,2'-oxirane]-9-yl]-4-methoxy-3,5,9-trimethyl-6-oxododec-1-enyl]-N-methylformamide
Also Known As: Tolytoxin, 6-Hydroxy-7-O-methylscytophycin B, Scytophycin B, 6-hydroxy-7-O-methyl-, N-[(E,3R,4R,5R,9S,10S,11S)-10-hydroxy-11-[(1S,3S,4S,5S,7R,8S,9R,12E,14E,16S,17R,19R)-16-hydroxy-3,5,7,17-tetramethoxy-8,14-dimethyl-11-oxospiro[10,23-dioxabicyclo[17.3.1]tricosa-12,14,20-triene-4,2'-oxirane]-9-yl]-4-methoxy-3,5,9-trimethyl-6-oxododec-1-enyl]-N-methylformamide, 2,7,10-Trioxa-4-azadodecan-12-oic acid, 1-(9H-fluoren-9-yl)-3-oxo-
Technical Specifications
| Molecular Formula | C46H75NO13 |
| Molecular Weight | 849.52386 g/mol |
| XLogP | 3.9 |
| Topological Polar Surface Area (TPSA) | 172.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 13 |
| Rotatable Bonds | 16 |
| Exact Mass | 849.52386 Da |
| Heavy Atoms | 60 |
| Complexity | 1470.0 |
| SMILES | C[C@H]1[C@@H](C[C@@H]([C@]2(CO2)[C@H](C[C@@H]3CC=C[C@H](O3)C[C@H]([C@H](/C=C(/C=C/C(=O)O[C@@H]1[C@@H](C)[C@H]([C@@H](C)CCC(=O)[C@H](C)[C@@H]([C@H](C)/C=C/N(C)C=O)OC)O)\C)O)OC)OC)OC)OC |
| InChIKey | FTGOWEQDZZMPNJ-GUMZKTDUSA-N |
Chemical Property Profile of Tolytoxin
Property Insights of Tolytoxin
The XLogP value of 3.9 indicates that Tolytoxin is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 172.0 Ų indicates high polarity, suggesting Tolytoxin may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Tolytoxin has 2 hydrogen bond donor(s) and 13 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of Tolytoxin?
The CAS number of Tolytoxin is 127999-44-4.
What is the molecular formula of Tolytoxin?
The molecular formula of Tolytoxin is C46H75NO13.
What is the molecular weight of Tolytoxin?
The molecular weight of Tolytoxin is 849.52386 g/mol.
Where can I buy Tolytoxin?
You can request a quote for Tolytoxin directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Tolytoxin?
Yes, CoreyChem provides custom synthesis services for Tolytoxin and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.