GM3(d18:1/18:0)
TL;DR: GM3(d18:1/18:0) (CAS 124579-05-1) is a chemical compound with molecular formula C59H108N2O21 and molecular weight 1180.7445 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S,4S,5R,6R)-5-acetamido-2-[(2S,3R,4S,5S,6R)-2-[(2R,3S,4R,5R,6R)-4,5-dihydroxy-2-(hydroxymethyl)-6-[(E,2S,3R)-3-hydroxy-2-(octadecanoylamino)octadec-4-enoxy]oxan-3-yl]oxy-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-4-hydroxy-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxylic acid
Also Known As: Ganglioside GM3, GM3-d18:1/18:0, GM3(d18:1/18:0), NeuAcalpha2-3Galbeta1-4Glcbeta-Cer(d18:1/18:0), alpha-Neu5Ac-(2->3)-beta-D-Gal-(1->4)-beta-D-Glc-(1<->1')-Cer(d18:1/18:0)
Technical Specifications
| Molecular Formula | C59H108N2O21 |
| Molecular Weight | 1180.7445 g/mol |
| XLogP | 7.7 |
| Topological Polar Surface Area (TPSA) | 373.0 Ų |
| Hydrogen Bond Donors | 14 |
| Hydrogen Bond Acceptors | 21 |
| Rotatable Bonds | 45 |
| Exact Mass | 1180.7445 Da |
| Heavy Atoms | 82 |
| Complexity | 1740.0 |
| SMILES | CCCCCCCCCCCCCCCCCC(=O)N[C@@H](CO[C@H]1[C@@H]([C@H]([C@@H]([C@H](O1)CO)O[C@H]2[C@@H]([C@H]([C@H]([C@H](O2)CO)O)O[C@@]3(C[C@@H]([C@H]([C@@H](O3)[C@@H]([C@@H](CO)O)O)NC(=O)C)O)C(=O)O)O)O)O)[C@@H](/C=C/CCCCCCCCCCCCC)O |
| InChIKey | UIKPUUZBQYTDRX-YRRBDHRDSA-N |
Chemical Property Profile of GM3(d18:1/18:0)
Property Insights of GM3(d18:1/18:0)
The XLogP value of 7.7 indicates that GM3(d18:1/18:0) is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 373.0 Ų indicates high polarity, suggesting GM3(d18:1/18:0) may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, GM3(d18:1/18:0) has 14 hydrogen bond donor(s) and 21 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
What is the CAS number of GM3(d18:1/18:0)?
The CAS number of GM3(d18:1/18:0) is 124579-05-1.
What is the molecular formula of GM3(d18:1/18:0)?
The molecular formula of GM3(d18:1/18:0) is C59H108N2O21.
What is the molecular weight of GM3(d18:1/18:0)?
The molecular weight of GM3(d18:1/18:0) is 1180.7445 g/mol.
Where can I buy GM3(d18:1/18:0)?
You can request a quote for GM3(d18:1/18:0) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for GM3(d18:1/18:0)?
Yes, CoreyChem provides custom synthesis services for GM3(d18:1/18:0) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.