| Properties | Image |
|---|
| MNX_ID | MNXM955307 |
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| reference | slm:000647692 |
| formula | C53H95NO9P |
| global charge | -1 |
| mol weight | 921.315 |
| InChIKey | OQEWEEOKNAPWIR-LSTWIBCSSA-M |
| InChI | InChI=1S/C53H96NO9P/c1-4-7-10-13-16-19-21-23-25-27-29-32-34-37-40-43-51(55)54-46-47-61-64(58,59)62-49-50(63-53(57)45-42-39-36-31-18-15-12-9-6-3)48-60-52(56)44-41-38-35-33-30-28-26-24-22-20-17-14-11-8-5-2/h17,19-21,24,26,30,33,50H,4-16,18,22-23,25,27-29,31-32,34-49H2,1-3H3,(H,54,55)(H,58,59)/p-1/b20-17-,21-19-,26-24-,33-30-/t50-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\CCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCCCCC/C=C\CCCCCC)OC(=O)CCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C53H96NO9P/c1-4-7-10-13-16-19-21-23-25-27-29-32-34-37-40-43-51(55)54-46-47-61-64(58,59)62-49-50(63-53(57)45-42-39-36-31-18-15-12-9-6-3)48-60-52(56)44-41-38-35-33-30-28-26-24-22-20-17-14-11-8-5-2/h17,19-21,24,26,30,33,50H,4-16,18,22-23,25,27-29,31-32,34-49H2,1-3H3,(H,54,55)(H,58,59)/b20-17-,21-19-,26-24-,33-30-/t50-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16]/[CH:19]=[CH:21]\[CH2:23][CH2:25][CH2:27][CH2:29][CH2:32][CH2:34][CH2:37][CH2:40][CH2:43][C:51](=[N:54][CH2:46][CH2:47][O:61][P:64]([OH:58])(=[O:59])[O:62][CH2:49][C@@H:50]([CH2:48][O:60][C:52]([CH2:44][CH2:41][CH2:38][CH2:35]/[CH:33]=[CH:30]\[CH2:28]/[CH:26]=[CH:24]\[CH2:22]/[CH:20]=[CH:17]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:56])[O:63][C:53]([CH2:45][CH2:42][CH2:39][CH2:36][CH2:31][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:57])[OH:55] |
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