| Properties | Image |
|---|
| MNX_ID | MNXM1019159 |
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| reference | slm:000711548 |
| formula | C67H117NO8P |
| global charge | -1 |
| mol weight | 1095.646 |
| InChIKey | CTQYCKICSSVWDJ-PQSHGGIFSA-M |
| InChI | InChI=1S/C67H118NO8P/c1-4-7-10-13-16-19-22-25-28-30-31-32-33-34-35-36-38-41-44-47-50-53-56-59-67(70)76-65(63-73-61-57-54-51-48-45-42-39-29-26-23-20-17-14-11-8-5-2)64-75-77(71,72)74-62-60-68-66(69)58-55-52-49-46-43-40-37-27-24-21-18-15-12-9-6-3/h7,10,16,19-20,23,25,28,31-32,34-35,38,41,57,61,65H,4-6,8-9,11-15,17-18,21-22,24,26-27,29-30,33,36-37,39-40,42-56,58-60,62-64H2,1-3H3,(H,68,69)(H,71,72)/p-1/b10-7-,19-16-,23-20-,28-25-,32-31-,35-34-,41-38-,61-57-/t65-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCC(=O)O[C@H](CO/C=C\CCCCCCCC/C=C\CCCCCC)COP(=O)([O-])OCCNC(=O)CCCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C67H118NO8P/c1-4-7-10-13-16-19-22-25-28-30-31-32-33-34-35-36-38-41-44-47-50-53-56-59-67(70)76-65(63-73-61-57-54-51-48-45-42-39-29-26-23-20-17-14-11-8-5-2)64-75-77(71,72)74-62-60-68-66(69)58-55-52-49-46-43-40-37-27-24-21-18-15-12-9-6-3/h7,10,16,19-20,23,25,28,31-32,34-35,38,41,57,61,65H,4-6,8-9,11-15,17-18,21-22,24,26-27,29-30,33,36-37,39-40,42-56,58-60,62-64H2,1-3H3,(H,68,69)(H,71,72)/b10-7-,19-16-,23-20-,28-25-,32-31-,35-34-,41-38-,61-57-/t65-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:10]\[CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:28]\[CH2:30]/[CH:31]=[CH:32]\[CH2:33]/[CH:34]=[CH:35]\[CH2:36]/[CH:38]=[CH:41]\[CH2:44][CH2:47][CH2:50][CH2:53][CH2:56][CH2:59][C:67](=[O:70])[O:76][C@H:65]([CH2:63][O:73]/[CH:61]=[CH:57]\[CH2:54][CH2:51][CH2:48][CH2:45][CH2:42][CH2:39][CH2:29][CH2:26]/[CH:23]=[CH:20]\[CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])[CH2:64][O:75][P:77]([OH:71])(=[O:72])[O:74][CH2:62][CH2:60][N:68]=[C:66]([CH2:58][CH2:55][CH2:52][CH2:49][CH2:46][CH2:43][CH2:40][CH2:37][CH2:27][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:69] |
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