Mgdg-O
TL;DR: Mgdg-O (CAS 348113-78-0) is a chemical compound with molecular formula C43H68O11 and molecular weight 760.48 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[(2S)-1-[8-[(1S,5S)-4-oxo-5-[(Z)-pent-2-enyl]cyclopent-2-en-1-yl]octanoyloxy]-3-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl] (7Z,10Z,13Z)-hexadeca-7,10,13-trienoate
Also Known As: Mgdg-O, beta-D-Galactopyranoside,, 1-(9S,13S,12-oxophytodienoyl)-2-(7Z,10Z,13Z)-hexadecatrienoyl-3-(beta-D-galactosyl)-sn-glycerol, [(2S)-1-[8-[(1S,5S)-4-oxo-5-[(Z)-pent-2-enyl]cyclopent-2-en-1-yl]octanoyloxy]-3-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl] (7Z,10Z,13Z)-hexadeca-7,10,13-trienoate, (2S)-1-(beta-D-galactopyranosyloxy)-3-[(8-{(1S,5S)-4-oxo-5-[(2Z)-pent-2-en-1-yl]cyclopent-2-en-1-yl}octanoyl)oxy]propan-2-yl (7Z,10Z,13Z)-hexadeca-7,10,13-trienoate
| Molecular Formula | C43H68O11 |
|---|---|
| Molecular Weight | 760.48 g/mol |
| LogP | 6.5255 |
| Topological Polar Surface Area | 169.05 Ų |
| Hydrogen Bond Donors | 4 |
| Hydrogen Bond Acceptors | 11 |
| Rotatable Bonds | 29 |
| Exact Mass | 760.47614 |
| Heavy Atoms | 54 |
| Complexity | 1189.7994 |
Chemical Identifiers
| CAS Number | 348113-78-0 |
|---|---|
| SMILES | CC/C=C\C/C=C\C/C=C\CCCCCC(=O)O[C@@H](CO[C@H]1[C@@H]([C@H]([C@H]([C@H](O1)CO)O)O)O)COC(=O)CCCCCCC[C@H]2C=CC(=O)[C@H]2C/C=C\CC |
Product Overview
Mgdg-O (CAS 348113-78-0), with molecular formula C43H68O11 and molecular weight 760.48 g/mol. IUPAC: [(2S)-1-[8-[(1S,5S)-4-oxo-5-[(Z)-pent-2-enyl]cyclopent-2-en-1-yl]octanoyloxy]-3-[(2R,3R,4S,5R,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxypropan-2-yl] (7Z,10Z,13Z)-hexadeca-7,10,13-trienoate.
Chemical Property Profile of Mgdg-O
Property Insights of Mgdg-O
The XLogP value of 6.5255 indicates that Mgdg-O is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 169.05 Ų indicates high polarity, suggesting Mgdg-O may have limited membrane permeability but good aqueous solubility. Following Lipinski's Rule of Five, Mgdg-O has 4 hydrogen bond donor(s) and 11 hydrogen bond acceptor(s), which may warrant consideration for formulation optimization.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of Mgdg-O?
The CAS number of Mgdg-O is 348113-78-0.
What is the molecular formula of Mgdg-O?
The molecular formula of Mgdg-O is C43H68O11.
What is the molecular weight of Mgdg-O?
The molecular weight of Mgdg-O is 760.48 g/mol.
Where can I buy Mgdg-O?
You can request a quote for Mgdg-O directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Mgdg-O?
Yes, KEHONG BIO provides custom synthesis services for Mgdg-O and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.