| Properties | Image |
|---|
| MNX_ID | MNXM226621 |
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| reference | slm:000497036 |
| formula | C71H119O8P |
| global charge | -2 |
| mol weight | 1131.699 |
| InChIKey | DEVOSKTWYWLIDU-JDUWOFQFSA-L |
| InChI | InChI=1S/C71H121O8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-34-35-36-38-40-42-44-46-48-50-52-54-56-58-60-62-64-66-71(73)79-69(68-78-80(74,75)76)67-77-70(72)65-63-61-59-57-55-53-51-49-47-45-43-41-39-37-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5,7,11-14,17-20,23-26,29-32,39,41,69H,3-4,6,8-10,15-16,21-22,27-28,33-38,40,42-68H2,1-2H3,(H2,74,75,76)/p-2/b7-5-,13-11-,14-12-,19-17-,20-18-,25-23-,26-24-,31-29-,32-30-,41-39-/t69-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])[O-] |
MNX internals
| InChI (mnx) | InChI=1/C71H121O8P/c1-3-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-34-35-36-38-40-42-44-46-48-50-52-54-56-58-60-62-64-66-71(73)79-69(68-78-80(74,75)76)67-77-70(72)65-63-61-59-57-55-53-51-49-47-45-43-41-39-37-32-30-28-26-24-22-20-18-16-14-12-10-8-6-4-2/h5,7,11-14,17-20,23-26,29-32,39,41,69H,3-4,6,8-10,15-16,21-22,27-28,33-38,40,42-68H2,1-2H3,(H2,74,75,76)/b7-5-,13-11-,14-12-,19-17-,20-18-,25-23-,26-24-,31-29-,32-30-,41-39-/t69-/m1/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:25]\[CH2:27]/[CH:29]=[CH:31]\[CH2:33][CH2:34][CH2:35][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][CH2:48][CH2:50][CH2:52][CH2:54][CH2:56][CH2:58][CH2:60][CH2:62][CH2:64][CH2:66][C:71](=[O:73])[O:79][C@H:69]([CH2:67][O:77][C:70]([CH2:65][CH2:63][CH2:61][CH2:59][CH2:57][CH2:55][CH2:53][CH2:51][CH2:49][CH2:47][CH2:45][CH2:43]/[CH:41]=[CH:39]\[CH2:37]/[CH:32]=[CH:30]\[CH2:28]/[CH:26]=[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:72])[CH2:68][O:78][P:80]([OH:74])([OH:75])=[O:76] |
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