| Properties | Image |
|---|
| MNX_ID | MNXM1037210 |
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| reference | slm:000729599 |
| formula | C67H123NO8P |
| global charge | -1 |
| mol weight | 1101.694 |
| InChIKey | ORNMGOKUGDASTA-ASCAVDCXSA-M |
| InChI | InChI=1S/C67H124NO8P/c1-4-7-10-13-16-19-22-25-27-29-30-31-32-33-34-35-37-39-42-45-48-51-54-57-61-73-63-65(76-67(70)59-56-53-50-47-44-40-24-21-18-15-12-9-6-3)64-75-77(71,72)74-62-60-68-66(69)58-55-52-49-46-43-41-38-36-28-26-23-20-17-14-11-8-5-2/h17,20-21,24,26,28,38,41,46,49,65H,4-16,18-19,22-23,25,27,29-37,39-40,42-45,47-48,50-64H2,1-3H3,(H,68,69)(H,71,72)/p-1/b20-17-,24-21-,28-26-,41-38-,49-46-/t65-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)NCCOP(=O)([O-])OC[C@@H](COCCCCCCCCCCCCCCCCCCCCCCCCCC)OC(=O)CCCCCCC/C=C\CCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C67H124NO8P/c1-4-7-10-13-16-19-22-25-27-29-30-31-32-33-34-35-37-39-42-45-48-51-54-57-61-73-63-65(76-67(70)59-56-53-50-47-44-40-24-21-18-15-12-9-6-3)64-75-77(71,72)74-62-60-68-66(69)58-55-52-49-46-43-41-38-36-28-26-23-20-17-14-11-8-5-2/h17,20-21,24,26,28,38,41,46,49,65H,4-16,18-19,22-23,25,27,29-37,39-40,42-45,47-48,50-64H2,1-3H3,(H,68,69)(H,71,72)/b20-17-,24-21-,28-26-,41-38-,49-46-/t65-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22][CH2:25][CH2:27][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:37][CH2:39][CH2:42][CH2:45][CH2:48][CH2:51][CH2:54][CH2:57][CH2:61][O:73][CH2:63][C@H:65]([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]/[CH:49]=[CH:46]\[CH2:43]/[CH:41]=[CH:38]\[CH2:36]/[CH:28]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])[OH:69])[O:76][C:67]([CH2:59][CH2:56][CH2:53][CH2:50][CH2:47][CH2:44][CH2:40]/[CH:24]=[CH:21]\[CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:70] |
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