| Properties | Image |
MNX_ID | MNXM106826 |
 |
reference | chebi:165687 |
formula | C28H52O2 |
global charge | 0 |
mol weight | 420.722 |
InChIKey | DLWIEMYWILBAKT-HWAYABPNSA-N |
InChI | InChI=1S/C28H52O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-30-28(29)26-24-22-20-18-16-14-12-10-8-6-4-2/h9-12H,3-8,13-27H2,1-2H3/b11-9-,12-10- |
SMILES | CCCC/C=C\CCCCCCCCOC(=O)CCCCCCC/C=C\CCCC |
MNX internals
InChI (mnx) | InChI=1/C28H52O2/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-30-28(29)26-24-22-20-18-16-14-12-10-8-6-4-2/h9-12H,3-8,13-27H2,1-2H3/b11-9-,12-10- |
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SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7]/[CH:9]=[CH:11]\[CH2:13][CH2:15][CH2:17][CH2:19][CH2:21][CH2:23][CH2:25][CH2:27][O:30][C:28]([CH2:26][CH2:24][CH2:22][CH2:20][CH2:18][CH2:16][CH2:14]/[CH:12]=[CH:10]\[CH2:8][CH2:6][CH2:4][CH3:2])=[O:29] |
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