| Properties | Image |
MNX_ID | MNXM276882 |
 |
reference | slm:000039723 |
formula | C56H100O10P |
global charge | -1 |
mol weight | 964.38 |
InChIKey | BJXSLTYUXWOLNX-XXEJRMDTSA-M |
InChI | InChI=1S/C56H101O10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-26-28-30-32-34-36-38-40-42-44-46-48-56(60)66-54(52-65-67(61,62)64-50-53(58)49-57)51-63-55(59)47-45-43-41-39-37-35-33-31-29-27-24-22-20-18-16-14-12-10-8-6-4-2/h12,14,18,20,24,27,31,33,37,39,53-54,57-58H,3-11,13,15-17,19,21-23,25-26,28-30,32,34-36,38,40-52H2,1-2H3,(H,61,62)/p-1/b14-12-,20-18-,27-24-,33-31-,39-37-/t53-,54+/m0/s1 |
SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@@H](O)CO)OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCC |
MNX internals
InChI (mnx) | InChI=1/C56H101O10P/c1-3-5-7-9-11-13-15-17-19-21-23-25-26-28-30-32-34-36-38-40-42-44-46-48-56(60)66-54(52-65-67(61,62)64-50-53(58)49-57)51-63-55(59)47-45-43-41-39-37-35-33-31-29-27-24-22-20-18-16-14-12-10-8-6-4-2/h12,14,18,20,24,27,31,33,37,39,53-54,57-58H,3-11,13,15-17,19,21-23,25-26,28-30,32,34-36,38,40-52H2,1-2H3,(H,61,62)/b14-12-,20-18-,27-24-,33-31-,39-37-/t53-,54+/m0/s1 |
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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][CH2:21][CH2:23][CH2:25][CH2:26][CH2:28][CH2:30][CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][CH2:48][C:56](=[O:60])[O:66][C@H:54]([CH2:51][O:63][C:55]([CH2:47][CH2:45][CH2:43][CH2:41]/[CH:39]=[CH:37]\[CH2:35]/[CH:33]=[CH:31]\[CH2:29]/[CH:27]=[CH:24]\[CH2:22]/[CH:20]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:59])[CH2:52][O:65][P:67]([OH:61])(=[O:62])[O:64][CH2:50][C@H:53]([CH2:49][OH:57])[OH:58] |
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