| Properties | Image |
MNX_ID | MNXM30380 |
 |
reference | lipidmapsM:LMFA08020047 |
formula | C25H43NO2 |
global charge | 0 |
mol weight | 389.624 |
InChIKey | ISQLXYIUDZLLLP-PZSIIWHGSA-N |
InChI | InChI=1S/C25H43NO2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25(3,4)24(28)26-22-23(2)27/h9-10,12-13,15-16,18-19,23,27H,5-8,11,14,17,20-22H2,1-4H3,(H,26,28)/b10-9-,13-12-,16-15-,19-18-/t23-/m1/s1 |
SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCC(C)(C)C(=O)NC[C@@H](C)O |
MNX internals
InChI (mnx) | InChI=1/C25H43NO2/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25(3,4)24(28)26-22-23(2)27/h9-10,12-13,15-16,18-19,23,27H,5-8,11,14,17,20-22H2,1-4H3,(H,26,28)/b10-9-,13-12-,16-15-,19-18-/t23-/m1/s1 |
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SMILES (mnx) | [CH3:1][CH2:5][CH2:6][CH2:7][CH2:8]/[CH:9]=[CH:10]\[CH2:11]/[CH:12]=[CH:13]\[CH2:14]/[CH:15]=[CH:16]\[CH2:17]/[CH:18]=[CH:19]\[CH2:20][CH2:21][C:25]([CH3:3])([CH3:4])[C:24](=[N:26][CH2:22][C@@H:23]([CH3:2])[OH:27])[OH:28] |
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