| Properties | Image |
MNX_ID | MNXM107538 |
 |
reference | chebi:165708 |
formula | C38H74O2 |
global charge | 0 |
mol weight | 563.008 |
InChIKey | QCRXLUYBLSSGEZ-PEZBUJJGSA-N |
InChI | InChI=1S/C38H74O2/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-26-28-30-32-34-36-38(39)40-37-35-33-31-29-27-25-18-16-14-12-10-8-6-4-2/h14,16H,3-13,15,17-37H2,1-2H3/b16-14- |
SMILES | CCCCCC/C=C\CCCCCCCCOC(=O)CCCCCCCCCCCCCCCCCCCCC |
MNX internals
InChI (mnx) | InChI=1/C38H74O2/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-26-28-30-32-34-36-38(39)40-37-35-33-31-29-27-25-18-16-14-12-10-8-6-4-2/h14,16H,3-13,15,17-37H2,1-2H3/b16-14- |
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SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15][CH2:17][CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:26][CH2:28][CH2:30][CH2:32][CH2:34][CH2:36][C:38](=[O:39])[O:40][CH2:37][CH2:35][CH2:33][CH2:31][CH2:29][CH2:27][CH2:25][CH2:18]/[CH:16]=[CH:14]\[CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2] |
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