| Properties | Image |
|---|
| MNX_ID | MNXM1041304 |
 |
| reference | slm:000733693 |
| formula | C53H95NO8P |
| global charge | -1 |
| mol weight | 905.316 |
| InChIKey | IOCZDCVLDMDXEB-HTDKHDTCSA-M |
| InChI | InChI=1S/C53H96NO8P/c1-4-7-10-13-16-19-21-23-25-27-29-31-34-37-40-43-47-59-49-51(62-53(56)45-42-39-36-33-30-28-26-24-22-20-17-14-11-8-5-2)50-61-63(57,58)60-48-46-54-52(55)44-41-38-35-32-18-15-12-9-6-3/h8,11,17,20,23-26,30,33,51H,4-7,9-10,12-16,18-19,21-22,27-29,31-32,34-50H2,1-3H3,(H,54,55)(H,57,58)/p-1/b11-8-,20-17-,25-23-,26-24-,33-30-/t51-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)O[C@H](COCCCCCCCC/C=C\CCCCCCCC)COP(=O)([O-])OCCNC(=O)CCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C53H96NO8P/c1-4-7-10-13-16-19-21-23-25-27-29-31-34-37-40-43-47-59-49-51(62-53(56)45-42-39-36-33-30-28-26-24-22-20-17-14-11-8-5-2)50-61-63(57,58)60-48-46-54-52(55)44-41-38-35-32-18-15-12-9-6-3/h8,11,17,20,23-26,30,33,51H,4-7,9-10,12-16,18-19,21-22,27-29,31-32,34-50H2,1-3H3,(H,54,55)(H,57,58)/b11-8-,20-17-,25-23-,26-24-,33-30-/t51-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:21]/[CH:23]=[CH:25]\[CH2:27][CH2:29][CH2:31][CH2:34][CH2:37][CH2:40][CH2:43][CH2:47][O:59][CH2:49][C@H:51]([CH2:50][O:61][P:63]([OH:57])(=[O:58])[O:60][CH2:48][CH2:46][N:54]=[C:52]([CH2:44][CH2:41][CH2:38][CH2:35][CH2:32][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:55])[O:62][C:53]([CH2:45][CH2:42][CH2:39][CH2:36]/[CH:33]=[CH:30]\[CH2:28]/[CH:26]=[CH:24]\[CH2:22]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:56] |
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