| Properties | Image |
|---|
| MNX_ID | MNXM963352 |
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| reference | slm:000655737 |
| formula | C68H119NO9P |
| global charge | -1 |
| mol weight | 1125.672 |
| InChIKey | AOOQOROQCHHECM-GYQQCWINSA-M |
| InChI | InChI=1S/C68H120NO9P/c1-4-7-10-13-16-19-22-25-28-30-31-32-33-34-35-36-39-41-44-47-50-53-56-59-67(71)75-63-65(78-68(72)60-57-54-51-48-45-42-38-29-26-23-20-17-14-11-8-5-2)64-77-79(73,74)76-62-61-69-66(70)58-55-52-49-46-43-40-37-27-24-21-18-15-12-9-6-3/h9,12,16,18-19,21,25,27-28,31-32,34-35,37,65H,4-8,10-11,13-15,17,20,22-24,26,29-30,33,36,38-64H2,1-3H3,(H,69,70)(H,73,74)/p-1/b12-9-,19-16-,21-18-,28-25-,32-31-,35-34-,37-27-/t65-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)NCCOP(=O)([O-])OC[C@@H](COC(=O)CCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C68H120NO9P/c1-4-7-10-13-16-19-22-25-28-30-31-32-33-34-35-36-39-41-44-47-50-53-56-59-67(71)75-63-65(78-68(72)60-57-54-51-48-45-42-38-29-26-23-20-17-14-11-8-5-2)64-77-79(73,74)76-62-61-69-66(70)58-55-52-49-46-43-40-37-27-24-21-18-15-12-9-6-3/h9,12,16,18-19,21,25,27-28,31-32,34-35,37,65H,4-8,10-11,13-15,17,20,22-24,26,29-30,33,36,38-64H2,1-3H3,(H,69,70)(H,73,74)/b12-9-,19-16-,21-18-,28-25-,32-31-,35-34-,37-27-/t65-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:30]/[CH:31]=[CH:32]\[CH2:33]/[CH:34]=[CH:35]\[CH2:36][CH2:39][CH2:41][CH2:44][CH2:47][CH2:50][CH2:53][CH2:56][CH2:59][C:67](=[O:71])[O:75][CH2:63][C@H:65]([CH2:64][O:77][P:79]([OH:73])(=[O:74])[O:76][CH2:62][CH2:61][N:69]=[C:66]([CH2:58][CH2:55][CH2:52][CH2:49][CH2:46][CH2:43][CH2:40]/[CH:37]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15]/[CH:12]=[CH:9]\[CH2:6][CH3:3])[OH:70])[O:78][C:68]([CH2:60][CH2:57][CH2:54][CH2:51][CH2:48][CH2:45][CH2:42][CH2:38][CH2:29][CH2:26][CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:72] |
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