| SpectraBase Spectrum ID |
CsO0xqC85NF |
| Name |
1,3-Di(9,10-methyleneoctadecanoyl)glycerol nicotinoyl derivative |
| Alternate Name(s) |
2-{[8-(2-octylcyclopropyl)octanoyl]oxy}-1-({[8-(2-octylcyclopropyl)octanoyl]oxy}methyl)ethyl nicotinate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C47H79NO6 |
| InChI |
InChI=1S/C47H79NO6/c1-3-5-7-9-13-19-26-39-34-41(39)28-21-15-11-17-23-31-45(49)52-37-44(54-47(51)43-30-25-33-48-36-43)38-53-46(50)32-24-18-12-16-22-29-42-35-40(42)27-20-14-10-8-6-4-2/h25,30,33,36,39-42,44H,3-24,26-29,31-32,34-35,37-38H2,1-2H3 |
| InChIKey |
AZQXKMYDHHCKRP-UHFFFAOYSA-N |
| Molecular Weight |
754.150 g/mol |
| SMILES |
C(c1cnccc1)(OC(COC(=O)CCCCCCCC1CC1CCCCCCCC)COC(=O)CCCCCCCC1CC1CCCCCCCC)=O |
| SPLASH |
splash10-0uk9-0700105900-d62ead2657371fa2f843 |
| Source of Spectrum |
O-31-411-0 |
| Wiley ID |
1416394 |
