| Properties | Image |
|---|
| MNX_ID | MNXM966498 |
 |
| reference | slm:000658883 |
| formula | C79H139NO9P |
| global charge | -1 |
| mol weight | 1277.953 |
| InChIKey | PKIKAAULUGLMAC-BFEVMYEKSA-M |
| InChI | InChI=1S/C79H140NO9P/c1-4-7-10-13-16-19-21-23-25-27-29-31-33-35-37-38-40-41-43-45-47-49-51-53-55-58-61-64-67-70-78(82)86-74-76(75-88-90(84,85)87-73-72-80-77(81)69-66-63-60-57-18-15-12-9-6-3)89-79(83)71-68-65-62-59-56-54-52-50-48-46-44-42-39-36-34-32-30-28-26-24-22-20-17-14-11-8-5-2/h16-17,19-20,23-26,29-32,35-37,39,76H,4-15,18,21-22,27-28,33-34,38,40-75H2,1-3H3,(H,80,81)(H,84,85)/p-1/b19-16-,20-17-,25-23-,26-24-,31-29-,32-30-,37-35-,39-36-/t76-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCCCCCCC)OC(=O)CCCCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C79H140NO9P/c1-4-7-10-13-16-19-21-23-25-27-29-31-33-35-37-38-40-41-43-45-47-49-51-53-55-58-61-64-67-70-78(82)86-74-76(75-88-90(84,85)87-73-72-80-77(81)69-66-63-60-57-18-15-12-9-6-3)89-79(83)71-68-65-62-59-56-54-52-50-48-46-44-42-39-36-34-32-30-28-26-24-22-20-17-14-11-8-5-2/h16-17,19-20,23-26,29-32,35-37,39,76H,4-15,18,21-22,27-28,33-34,38,40-75H2,1-3H3,(H,80,81)(H,84,85)/b19-16-,20-17-,25-23-,26-24-,31-29-,32-30-,37-35-,39-36-/t76-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:21]/[CH:23]=[CH:25]\[CH2:27]/[CH:29]=[CH:31]\[CH2:33]/[CH:35]=[CH:37]\[CH2:38][CH2:40][CH2:41][CH2:43][CH2:45][CH2:47][CH2:49][CH2:51][CH2:53][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][CH2:60][CH2:57][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:81])[O:89][C:79]([CH2:71][CH2:68][CH2:65][CH2:62][CH2:59][CH2:56][CH2:54][CH2:52][CH2:50][CH2:48][CH2:46][CH2:44][CH2:42]/[CH:39]=[CH:36]\[CH2:34]/[CH:32]=[CH:30]\[CH2:28]/[CH:26]=[CH:24]\[CH2:22]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:83] |
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