| Properties | Image |
|---|
| MNX_ID | MNXM939223 |
 |
| reference | slm:000631608 |
| formula | C77H129NO9P |
| global charge | -1 |
| mol weight | 1243.851 |
| InChIKey | SVDUNEONNUYLRU-MIBLILPLSA-M |
| InChI | InChI=1S/C77H130NO9P/c1-4-7-10-12-14-16-18-20-22-24-26-28-30-32-34-35-36-37-38-39-41-42-44-46-48-50-52-54-56-58-60-62-65-68-76(80)84-72-74(73-86-88(82,83)85-71-70-78-75(79)67-64-9-6-3)87-77(81)69-66-63-61-59-57-55-53-51-49-47-45-43-40-33-31-29-27-25-23-21-19-17-15-13-11-8-5-2/h7-8,10-11,14-17,20-23,26-29,32-34,40,45,47,74H,4-6,9,12-13,18-19,24-25,30-31,35-39,41-44,46,48-73H2,1-3H3,(H,78,79)(H,82,83)/p-1/b10-7-,11-8-,16-14-,17-15-,22-20-,23-21-,28-26-,29-27-,34-32-,40-33-,47-45-/t74-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CC)COP(=O)([O-])OCCNC(=O)CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C77H130NO9P/c1-4-7-10-12-14-16-18-20-22-24-26-28-30-32-34-35-36-37-38-39-41-42-44-46-48-50-52-54-56-58-60-62-65-68-76(80)84-72-74(73-86-88(82,83)85-71-70-78-75(79)67-64-9-6-3)87-77(81)69-66-63-61-59-57-55-53-51-49-47-45-43-40-33-31-29-27-25-23-21-19-17-15-13-11-8-5-2/h7-8,10-11,14-17,20-23,26-29,32-34,40,45,47,74H,4-6,9,12-13,18-19,24-25,30-31,35-39,41-44,46,48-73H2,1-3H3,(H,78,79)(H,82,83)/b10-7-,11-8-,16-14-,17-15-,22-20-,23-21-,28-26-,29-27-,34-32-,40-33-,47-45-/t74-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:12]/[CH:14]=[CH:16]\[CH2:18]/[CH:20]=[CH:22]\[CH2:24]/[CH:26]=[CH:28]\[CH2:30]/[CH:32]=[CH:34]\[CH2:35][CH2:36][CH2:37][CH2:38][CH2:39][CH2:41][CH2:42][CH2:44][CH2:46][CH2:48][CH2:50][CH2:52][CH2:54][CH2:56][CH2:58][CH2:60][CH2:62][CH2:65][CH2:68][C:76](=[O:80])[O:84][CH2:72][C@H:74]([CH2:73][O:86][P:88]([OH:82])(=[O:83])[O:85][CH2:71][CH2:70][N:78]=[C:75]([CH2:67][CH2:64][CH2:9][CH2:6][CH3:3])[OH:79])[O:87][C:77]([CH2:69][CH2:66][CH2:63][CH2:61][CH2:59][CH2:57][CH2:55][CH2:53][CH2:51][CH2:49]/[CH:47]=[CH:45]\[CH2:43]/[CH:40]=[CH:33]\[CH2:31]/[CH:29]=[CH:27]\[CH2:25]/[CH:23]=[CH:21]\[CH2:19]/[CH:17]=[CH:15]\[CH2:13]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:81] |
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