| Properties | Image |
|---|
| MNX_ID | MNXM1040874 |
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| reference | slm:000733263 |
| formula | C54H99NO8P |
| global charge | -1 |
| mol weight | 921.359 |
| InChIKey | BXSPUCZWBQRZSD-JATPDDDKSA-M |
| InChI | InChI=1S/C54H100NO8P/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-34-38-42-47-60-49-52(63-54(57)45-41-37-33-30-31-35-39-43-51(3)4)50-62-64(58,59)61-48-46-55-53(56)44-40-36-32-28-26-24-22-20-18-16-14-12-10-8-6-2/h8,10,14-17,20,22,51-52H,5-7,9,11-13,18-19,21,23-50H2,1-4H3,(H,55,56)(H,58,59)/p-1/b10-8-,16-14-,17-15-,22-20-/t52-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\CCCCCCCC(=O)NCCOP(=O)([O-])OC[C@@H](COCCCCCCCCCC/C=C\CCCCCC)OC(=O)CCCCCCCCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C54H100NO8P/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-34-38-42-47-60-49-52(63-54(57)45-41-37-33-30-31-35-39-43-51(3)4)50-62-64(58,59)61-48-46-55-53(56)44-40-36-32-28-26-24-22-20-18-16-14-12-10-8-6-2/h8,10,14-17,20,22,51-52H,5-7,9,11-13,18-19,21,23-50H2,1-4H3,(H,55,56)(H,58,59)/b10-8-,16-14-,17-15-,22-20-/t52-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13]/[CH:15]=[CH:17]\[CH2:19][CH2:21][CH2:23][CH2:25][CH2:27][CH2:29][CH2:34][CH2:38][CH2:42][CH2:47][O:60][CH2:49][C@H:52]([CH2:50][O:62][P:64]([OH:58])(=[O:59])[O:61][CH2:48][CH2:46][N:55]=[C:53]([CH2:44][CH2:40][CH2:36][CH2:32][CH2:28][CH2:26][CH2:24]/[CH:22]=[CH:20]\[CH2:18]/[CH:16]=[CH:14]\[CH2:12]/[CH:10]=[CH:8]\[CH2:6][CH3:2])[OH:56])[O:63][C:54]([CH2:45][CH2:41][CH2:37][CH2:33][CH2:30][CH2:31][CH2:35][CH2:39][CH2:43][CH:51]([CH3:3])[CH3:4])=[O:57] |
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