| Properties | Image |
MNX_ID | MNXM345739 |
 |
reference | slm:000041542 |
formula | C22H42O10P |
global charge | -1 |
mol weight | 497.542 |
InChIKey | WVQFOGJXWXHIKU-VQTJNVASSA-M |
InChI | InChI=1S/C22H43O10P/c1-3-5-7-8-9-10-12-13-21(25)29-17-20(32-22(26)14-11-6-4-2)18-31-33(27,28)30-16-19(24)15-23/h19-20,23-24H,3-18H2,1-2H3,(H,27,28)/p-1/t19-,20+/m0/s1 |
SMILES | CCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@@H](O)CO)OC(=O)CCCCC |
MNX internals
InChI (mnx) | InChI=1/C22H43O10P/c1-3-5-7-8-9-10-12-13-21(25)29-17-20(32-22(26)14-11-6-4-2)18-31-33(27,28)30-16-19(24)15-23/h19-20,23-24H,3-18H2,1-2H3,(H,27,28)/t19-,20+/m0/s1 |
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SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:8][CH2:9][CH2:10][CH2:12][CH2:13][C:21](=[O:25])[O:29][CH2:17][C@H:20]([CH2:18][O:31][P:33]([OH:27])(=[O:28])[O:30][CH2:16][C@H:19]([CH2:15][OH:23])[OH:24])[O:32][C:22]([CH2:14][CH2:11][CH2:6][CH2:4][CH3:2])=[O:26] |
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