| Properties | Image |
|---|
| MNX_ID | MNXM1031620 |
 |
| reference | slm:000724009 |
| formula | C76H135NO8P |
| global charge | -1 |
| mol weight | 1221.889 |
| InChIKey | WYMSXRUERSNBAG-IPCKZPGRSA-M |
| InChI | InChI=1S/C76H136NO8P/c1-5-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-40-42-47-51-55-59-63-67-76(79)85-74(71-82-69-64-60-56-52-48-44-43-45-49-53-57-61-65-73(3)4)72-84-86(80,81)83-70-68-77-75(78)66-62-58-54-50-46-41-39-20-18-16-14-12-10-8-6-2/h8,10,13-16,19-21,23-24,26-27,29-30,39,73-74H,5-7,9,11-12,17-18,22,25,28,31-38,40-72H2,1-4H3,(H,77,78)(H,80,81)/p-1/b10-8-,15-13-,16-14-,21-19-,24-23-,27-26-,30-29-,39-20-/t74-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)NCCOP(=O)([O-])OC[C@@H](COCCCCCCCCCCCCCCC(C)C)OC(=O)CCCCCCCCCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C76H136NO8P/c1-5-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-40-42-47-51-55-59-63-67-76(79)85-74(71-82-69-64-60-56-52-48-44-43-45-49-53-57-61-65-73(3)4)72-84-86(80,81)83-70-68-77-75(78)66-62-58-54-50-46-41-39-20-18-16-14-12-10-8-6-2/h8,10,13-16,19-21,23-24,26-27,29-30,39,73-74H,5-7,9,11-12,17-18,22,25,28,31-38,40-72H2,1-4H3,(H,77,78)(H,80,81)/b10-8-,15-13-,16-14-,21-19-,24-23-,27-26-,30-29-,39-20-/t74-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:5][CH2:7][CH2:9][CH2:11]/[CH:13]=[CH:15]\[CH2:17]/[CH:19]=[CH:21]\[CH2:22]/[CH:23]=[CH:24]\[CH2:25]/[CH:26]=[CH:27]\[CH2:28]/[CH:29]=[CH:30]\[CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:40][CH2:42][CH2:47][CH2:51][CH2:55][CH2:59][CH2:63][CH2:67][C:76](=[O:79])[O:85][C@H:74]([CH2:71][O:82][CH2:69][CH2:64][CH2:60][CH2:56][CH2:52][CH2:48][CH2:44][CH2:43][CH2:45][CH2:49][CH2:53][CH2:57][CH2:61][CH2:65][CH:73]([CH3:3])[CH3:4])[CH2:72][O:84][P:86]([OH:80])(=[O:81])[O:83][CH2:70][CH2:68][N:77]=[C:75]([CH2:66][CH2:62][CH2:58][CH2:54][CH2:50][CH2:46][CH2:41]/[CH:39]=[CH:20]\[CH2:18]/[CH:16]=[CH:14]\[CH2:12]/[CH:10]=[CH:8]\[CH2:6][CH3:2])[OH:78] |
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