| Properties | Image |
|---|
| MNX_ID | MNXM960883 |
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| reference | slm:000653268 |
| formula | C53H93NO9P |
| global charge | -1 |
| mol weight | 919.299 |
| InChIKey | YBUFYBHGHMRWGE-AATAQVHQSA-M |
| InChI | InChI=1S/C53H94NO9P/c1-4-7-10-13-16-18-20-22-23-24-25-26-27-29-30-32-35-38-41-44-52(56)60-48-50(63-53(57)45-42-39-36-33-31-28-21-19-17-14-11-8-5-2)49-62-64(58,59)61-47-46-54-51(55)43-40-37-34-15-12-9-6-3/h16,18,22-23,25-26,29-31,33,50H,4-15,17,19-21,24,27-28,32,34-49H2,1-3H3,(H,54,55)(H,58,59)/p-1/b18-16-,23-22-,26-25-,30-29-,33-31-/t50-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCCCCC)OC(=O)CCCC/C=C\CCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C53H94NO9P/c1-4-7-10-13-16-18-20-22-23-24-25-26-27-29-30-32-35-38-41-44-52(56)60-48-50(63-53(57)45-42-39-36-33-31-28-21-19-17-14-11-8-5-2)49-62-64(58,59)61-47-46-54-51(55)43-40-37-34-15-12-9-6-3/h16,18,22-23,25-26,29-31,33,50H,4-15,17,19-21,24,27-28,32,34-49H2,1-3H3,(H,54,55)(H,58,59)/b18-16-,23-22-,26-25-,30-29-,33-31-/t50-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:18]\[CH2:20]/[CH:22]=[CH:23]\[CH2:24]/[CH:25]=[CH:26]\[CH2:27]/[CH:29]=[CH:30]\[CH2:32][CH2:35][CH2:38][CH2:41][CH2:44][C:52](=[O:56])[O:60][CH2:48][C@H:50]([CH2:49][O:62][P:64]([OH:58])(=[O:59])[O:61][CH2:47][CH2:46][N:54]=[C:51]([CH2:43][CH2:40][CH2:37][CH2:34][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:55])[O:63][C:53]([CH2:45][CH2:42][CH2:39][CH2:36]/[CH:33]=[CH:31]\[CH2:28][CH2:21][CH2:19][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:57] |
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