| Properties | Image |
|---|
| MNX_ID | MNXM967248 |
 |
| reference | slm:000659633 |
| formula | C79H131NO9P |
| global charge | -1 |
| mol weight | 1269.889 |
| InChIKey | QJDAYVZVYKYHOI-IUIDQNRCSA-M |
| InChI | InChI=1S/C79H132NO9P/c1-4-7-10-13-16-19-22-25-28-31-32-33-34-35-36-37-38-39-40-41-42-43-44-47-49-52-55-58-61-64-67-70-78(82)86-74-76(89-79(83)71-68-65-62-59-56-53-50-46-30-27-24-21-18-15-12-9-6-3)75-88-90(84,85)87-73-72-80-77(81)69-66-63-60-57-54-51-48-45-29-26-23-20-17-14-11-8-5-2/h9,12,16-21,25-30,32-33,35-36,48,50-51,53,57,60,76H,4-8,10-11,13-15,22-24,31,34,37-47,49,52,54-56,58-59,61-75H2,1-3H3,(H,80,81)(H,84,85)/p-1/b12-9-,19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,33-32-,36-35-,51-48-,53-50-,60-57-/t76-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])OCCNC(=O)CCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C79H132NO9P/c1-4-7-10-13-16-19-22-25-28-31-32-33-34-35-36-37-38-39-40-41-42-43-44-47-49-52-55-58-61-64-67-70-78(82)86-74-76(89-79(83)71-68-65-62-59-56-53-50-46-30-27-24-21-18-15-12-9-6-3)75-88-90(84,85)87-73-72-80-77(81)69-66-63-60-57-54-51-48-45-29-26-23-20-17-14-11-8-5-2/h9,12,16-21,25-30,32-33,35-36,48,50-51,53,57,60,76H,4-8,10-11,13-15,22-24,31,34,37-47,49,52,54-56,58-59,61-75H2,1-3H3,(H,80,81)(H,84,85)/b12-9-,19-16-,20-17-,21-18-,28-25-,29-26-,30-27-,33-32-,36-35-,51-48-,53-50-,60-57-/t76-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:31]/[CH:32]=[CH:33]\[CH2:34]/[CH:35]=[CH:36]\[CH2:37][CH2:38][CH2:39][CH2:40][CH2:41][CH2:42][CH2:43][CH2:44][CH2:47][CH2:49][CH2:52][CH2:55][CH2:58][CH2:61][CH2:64][CH2:67][CH2:70][C:78](=[O:82])[O:86][CH2:74][C@H:76]([CH2:75][O:88][P:90]([OH:84])(=[O:85])[O:87][CH2:73][CH2:72][N:80]=[C:77]([CH2:69][CH2:66][CH2:63]/[CH:60]=[CH:57]\[CH2:54]/[CH:51]=[CH:48]\[CH2:45]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])[OH:81])[O:89][C:79]([CH2:71][CH2:68][CH2:65][CH2:62][CH2:59][CH2:56]/[CH:53]=[CH:50]\[CH2:46]/[CH:30]=[CH:27]\[CH2:24]/[CH:21]=[CH:18]\[CH2:15]/[CH:12]=[CH:9]\[CH2:6][CH3:3])=[O:83] |
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