| Properties | Image |
|---|
| MNX_ID | MNXM951220 |
 |
| reference | slm:000643605 |
| formula | C69H121NO9P |
| global charge | -1 |
| mol weight | 1139.699 |
| InChIKey | SAMYKCRGIXLQQW-UZIJRDJPSA-M |
| InChI | InChI=1S/C69H122NO9P/c1-4-7-10-13-16-19-22-25-27-28-29-30-31-32-33-34-35-36-37-38-40-43-46-49-52-55-58-61-69(73)79-66(64-76-68(72)60-57-54-51-48-45-41-24-21-18-15-12-9-6-3)65-78-80(74,75)77-63-62-70-67(71)59-56-53-50-47-44-42-39-26-23-20-17-14-11-8-5-2/h12,15-16,19,21,24-27,29-30,32-33,39,66H,4-11,13-14,17-18,20,22-23,28,31,34-38,40-65H2,1-3H3,(H,70,71)(H,74,75)/p-1/b15-12-,19-16-,24-21-,27-25-,30-29-,33-32-,39-26-/t66-/m1/s1 |
| SMILES | CCC/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCCC/C=C\CCCCCCCC)OC(=O)CCCCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C69H122NO9P/c1-4-7-10-13-16-19-22-25-27-28-29-30-31-32-33-34-35-36-37-38-40-43-46-49-52-55-58-61-69(73)79-66(64-76-68(72)60-57-54-51-48-45-41-24-21-18-15-12-9-6-3)65-78-80(74,75)77-63-62-70-67(71)59-56-53-50-47-44-42-39-26-23-20-17-14-11-8-5-2/h12,15-16,19,21,24-27,29-30,32-33,39,66H,4-11,13-14,17-18,20,22-23,28,31,34-38,40-65H2,1-3H3,(H,70,71)(H,74,75)/b15-12-,19-16-,24-21-,27-25-,30-29-,33-32-,39-26-/t66-/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:27]\[CH2:28]/[CH:29]=[CH:30]\[CH2:31]/[CH:32]=[CH:33]\[CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:40][CH2:43][CH2:46][CH2:49][CH2:52][CH2:55][CH2:58][CH2:61][C:69](=[O:73])[O:79][C@H:66]([CH2:64][O:76][C:68]([CH2:60][CH2:57][CH2:54][CH2:51][CH2:48][CH2:45][CH2:41]/[CH:24]=[CH:21]\[CH2:18]/[CH:15]=[CH:12]\[CH2:9][CH2:6][CH3:3])=[O:72])[CH2:65][O:78][P:80]([OH:74])(=[O:75])[O:77][CH2:63][CH2:62][N:70]=[C:67]([CH2:59][CH2:56][CH2:53][CH2:50][CH2:47][CH2:44][CH2:42]/[CH:39]=[CH:26]\[CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])[OH:71] |
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