| Properties | Image |
|---|
| MNX_ID | MNXM962955 |
 |
| reference | slm:000655340 |
| formula | C69H119NO9P |
| global charge | -1 |
| mol weight | 1137.683 |
| InChIKey | GKRMESSHZWRSOW-ZLKBJKOKSA-M |
| InChI | InChI=1S/C69H120NO9P/c1-4-7-10-13-16-18-20-22-24-26-28-30-32-33-35-37-39-41-43-45-47-49-52-55-58-61-69(73)79-66(65-78-80(74,75)77-63-62-70-67(71)59-56-53-50-15-12-9-6-3)64-76-68(72)60-57-54-51-48-46-44-42-40-38-36-34-31-29-27-25-23-21-19-17-14-11-8-5-2/h16-19,22-25,28-31,33,35-36,38,66H,4-15,20-21,26-27,32,34,37,39-65H2,1-3H3,(H,70,71)(H,74,75)/p-1/b18-16-,19-17-,24-22-,25-23-,30-28-,31-29-,35-33-,38-36-/t66-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])OCCNC(=O)CCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C69H120NO9P/c1-4-7-10-13-16-18-20-22-24-26-28-30-32-33-35-37-39-41-43-45-47-49-52-55-58-61-69(73)79-66(65-78-80(74,75)77-63-62-70-67(71)59-56-53-50-15-12-9-6-3)64-76-68(72)60-57-54-51-48-46-44-42-40-38-36-34-31-29-27-25-23-21-19-17-14-11-8-5-2/h16-19,22-25,28-31,33,35-36,38,66H,4-15,20-21,26-27,32,34,37,39-65H2,1-3H3,(H,70,71)(H,74,75)/b18-16-,19-17-,24-22-,25-23-,30-28-,31-29-,35-33-,38-36-/t66-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:18]\[CH2:20]/[CH:22]=[CH:24]\[CH2:26]/[CH:28]=[CH:30]\[CH2:32]/[CH:33]=[CH:35]\[CH2:37][CH2:39][CH2:41][CH2:43][CH2:45][CH2:47][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][CH2:46][CH2:44][CH2:42][CH2:40]/[CH:38]=[CH:36]\[CH2:34]/[CH:31]=[CH:29]\[CH2:27]/[CH:25]=[CH:23]\[CH2:21]/[CH:19]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[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][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:71] |
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