| Properties | Image |
|---|
| MNX_ID | MNXM227138 |
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| reference | slm:000498548 |
| formula | C54H98NO8P |
| global charge | 0 |
| mol weight | 920.351 |
| InChIKey | BGZAHDHJGIKXKA-KLZAPUCNSA-N |
| InChI | InChI=1S/C54H98NO8P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-35-36-38-40-42-44-46-53(56)60-50-52(51-62-64(58,59)61-49-48-55)63-54(57)47-45-43-41-39-37-34-18-16-14-12-10-8-6-4-2/h11,13,17,19,21-22,24-25,27-28,52H,3-10,12,14-16,18,20,23,26,29-51,55H2,1-2H3,(H,58,59)/b13-11-,19-17-,22-21-,25-24-,28-27-/t52-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[NH3+])OC(=O)CCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C54H98NO8P/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-35-36-38-40-42-44-46-53(56)60-50-52(51-62-64(58,59)61-49-48-55)63-54(57)47-45-43-41-39-37-34-18-16-14-12-10-8-6-4-2/h11,13,17,19,21-22,24-25,27-28,52H,3-10,12,14-16,18,20,23,26,29-51,55H2,1-2H3,(H,58,59)/b13-11-,19-17-,22-21-,25-24-,28-27-/t52-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:20]/[CH:21]=[CH:22]\[CH2:23]/[CH:24]=[CH:25]\[CH2:26]/[CH:27]=[CH:28]\[CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:35][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][C:53](=[O:56])[O:60][CH2:50][C@H:52]([CH2:51][O:62][P:64]([OH:58])(=[O:59])[O:61][CH2:49][CH2:48][NH2:55])[O:63][C:54]([CH2:47][CH2:45][CH2:43][CH2:41][CH2:39][CH2:37][CH2:34][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:57] |
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