| Properties | Image |
|---|
| MNX_ID | MNXM182987 |
 |
| reference | slm:000036765 |
| formula | C66H114O10P |
| global charge | -1 |
| mol weight | 1098.602 |
| InChIKey | PKDTYTAHKZWADR-HJWGCFMRSA-M |
| InChI | InChI=1S/C66H115O10P/c1-3-5-7-9-11-13-15-17-19-21-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-40-42-44-46-48-50-52-54-56-58-66(70)76-64(62-75-77(71,72)74-60-63(68)59-67)61-73-65(69)57-55-53-51-49-47-45-43-41-39-22-20-18-16-14-12-10-8-6-4-2/h5,7,11-14,17-20,23-24,26-27,39,41,63-64,67-68H,3-4,6,8-10,15-16,21-22,25,28-38,40,42-62H2,1-2H3,(H,71,72)/p-1/b7-5-,13-11-,14-12-,19-17-,20-18-,24-23-,27-26-,41-39-/t63-,64+/m0/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCC/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])OC[C@@H](O)CO |
MNX internals
| InChI (mnx) | InChI=1/C66H115O10P/c1-3-5-7-9-11-13-15-17-19-21-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-40-42-44-46-48-50-52-54-56-58-66(70)76-64(62-75-77(71,72)74-60-63(68)59-67)61-73-65(69)57-55-53-51-49-47-45-43-41-39-22-20-18-16-14-12-10-8-6-4-2/h5,7,11-14,17-20,23-24,26-27,39,41,63-64,67-68H,3-4,6,8-10,15-16,21-22,25,28-38,40,42-62H2,1-2H3,(H,71,72)/b7-5-,13-11-,14-12-,19-17-,20-18-,24-23-,27-26-,41-39-/t63-,64+/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3]/[CH:5]=[CH:7]\[CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:21]/[CH:23]=[CH:24]\[CH2:25]/[CH:26]=[CH:27]\[CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][CH2:48][CH2:50][CH2:52][CH2:54][CH2:56][CH2:58][C:66](=[O:70])[O:76][C@H:64]([CH2:61][O:73][C:65]([CH2:57][CH2:55][CH2:53][CH2:51][CH2:49][CH2:47][CH2:45][CH2:43]/[CH:41]=[CH:39]\[CH2:22]/[CH:20]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:69])[CH2:62][O:75][P:77]([OH:71])(=[O:72])[O:74][CH2:60][C@H:63]([CH2:59][OH:67])[OH:68] |
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