| Properties | Image |
MNX_ID | MNXM104412 |
 |
reference | lipidmapsM:LMGL02010453 |
formula | C35H64O5 |
global charge | 0 |
mol weight | 564.892 |
InChIKey | STRPVFTYEKFVSQ-WIENOIJLSA-N |
InChI | InChI=1S/C35H64O5/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-35(38)40-33(31-36)32-39-34(37)29-27-25-23-21-19-16-14-12-10-8-6-4-2/h12,14-15,17,33,36H,3-11,13,16,18-32H2,1-2H3/b14-12-,17-15-/t33-/m0/s1 |
SMILES | CCCCC/C=C\CCCCCCCC(=O)OC[C@H](CO)OC(=O)CCCCCCC/C=C\CCCCCCC |
MNX internals
InChI (mnx) | InChI=1/C35H64O5/c1-3-5-7-9-11-13-15-17-18-20-22-24-26-28-30-35(38)40-33(31-36)32-39-34(37)29-27-25-23-21-19-16-14-12-10-8-6-4-2/h12,14-15,17,33,36H,3-11,13,16,18-32H2,1-2H3/b14-12-,17-15-/t33-/m0/s1 |
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SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13]/[CH:15]=[CH:17]\[CH2:18][CH2:20][CH2:22][CH2:24][CH2:26][CH2:28][CH2:30][C:35](=[O:38])[O:40][C@@H:33]([CH2:31][OH:36])[CH2:32][O:39][C:34]([CH2:29][CH2:27][CH2:25][CH2:23][CH2:21][CH2:19][CH2:16]/[CH:14]=[CH:12]\[CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:37] |
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