| Properties | Image |
|---|
| MNX_ID | MNXM181701 |
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| reference | slm:000020922 |
| formula | C57H101O8P |
| global charge | -2 |
| mol weight | 945.401 |
| InChIKey | HVQPMSWLBDMABL-IPAYOJLGSA-L |
| InChI | InChI=1S/C57H103O8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-28-30-31-33-35-37-39-41-43-45-47-49-51-56(58)63-53-55(54-64-66(60,61)62)65-57(59)52-50-48-46-44-42-40-38-36-34-32-29-26-24-22-20-18-16-14-12-10-8-6-4-2/h11,13,17,19,23,25,28,30,33,35,55H,3-10,12,14-16,18,20-22,24,26-27,29,31-32,34,36-54H2,1-2H3,(H2,60,61,62)/p-2/b13-11-,19-17-,25-23-,30-28-,35-33-/t55-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCC(=O)OC[C@H](COP(=O)([O-])[O-])OC(=O)CCCCCCCCCCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C57H103O8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-28-30-31-33-35-37-39-41-43-45-47-49-51-56(58)63-53-55(54-64-66(60,61)62)65-57(59)52-50-48-46-44-42-40-38-36-34-32-29-26-24-22-20-18-16-14-12-10-8-6-4-2/h11,13,17,19,23,25,28,30,33,35,55H,3-10,12,14-16,18,20-22,24,26-27,29,31-32,34,36-54H2,1-2H3,(H2,60,61,62)/b13-11-,19-17-,25-23-,30-28-,35-33-/t55-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:21]/[CH:23]=[CH:25]\[CH2:27]/[CH:28]=[CH:30]\[CH2:31]/[CH:33]=[CH:35]\[CH2:37][CH2:39][CH2:41][CH2:43][CH2:45][CH2:47][CH2:49][CH2:51][C:56](=[O:58])[O:63][CH2:53][C@H:55]([CH2:54][O:64][P:66]([OH:60])([OH:61])=[O:62])[O:65][C:57]([CH2:52][CH2:50][CH2:48][CH2:46][CH2:44][CH2:42][CH2:40][CH2:38][CH2:36][CH2:34][CH2:32][CH2:29][CH2:26][CH2:24][CH2:22][CH2:20][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:59] |
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