| Properties | Image |
|---|
| MNX_ID | MNXM276454 |
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| reference | slm:000039714 |
| formula | C44H74O10P |
| global charge | -1 |
| mol weight | 794.04 |
| InChIKey | HLVQURAYFAAQOQ-KHOXWLASSA-M |
| InChI | InChI=1S/C44H75O10P/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-23-24-26-27-29-31-33-35-43(47)51-39-42(40-53-55(49,50)52-38-41(46)37-45)54-44(48)36-34-32-30-28-25-14-12-10-8-6-4-2/h10-13,16-17,19-20,22-23,26-27,41-42,45-46H,3-9,14-15,18,21,24-25,28-40H2,1-2H3,(H,49,50)/p-1/b12-10-,13-11-,17-16-,20-19-,23-22-,27-26-/t41-,42+/m0/s1 |
| SMILES | CCCC/C=C\CCCCCCCC(=O)O[C@H](COC(=O)CCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])OC[C@@H](O)CO |
MNX internals
| InChI (mnx) | InChI=1/C44H75O10P/c1-3-5-7-9-11-13-15-16-17-18-19-20-21-22-23-24-26-27-29-31-33-35-43(47)51-39-42(40-53-55(49,50)52-38-41(46)37-45)54-44(48)36-34-32-30-28-25-14-12-10-8-6-4-2/h10-13,16-17,19-20,22-23,26-27,41-42,45-46H,3-9,14-15,18,21,24-25,28-40H2,1-2H3,(H,49,50)/b12-10-,13-11-,17-16-,20-19-,23-22-,27-26-/t41-,42+/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:16]=[CH:17]\[CH2:18]/[CH:19]=[CH:20]\[CH2:21]/[CH:22]=[CH:23]\[CH2:24]/[CH:26]=[CH:27]\[CH2:29][CH2:31][CH2:33][CH2:35][C:43](=[O:47])[O:51][CH2:39][C@H:42]([CH2:40][O:53][P:55]([OH:49])(=[O:50])[O:52][CH2:38][C@H:41]([CH2:37][OH:45])[OH:46])[O:54][C:44]([CH2:36][CH2:34][CH2:32][CH2:30][CH2:28][CH2:25][CH2:14]/[CH:12]=[CH:10]\[CH2:8][CH2:6][CH2:4][CH3:2])=[O:48] |
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