| Properties | Image |
|---|
| MNX_ID | MNXM962063 |
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| reference | slm:000654448 |
| formula | C63H113NO9P |
| global charge | -1 |
| mol weight | 1059.569 |
| InChIKey | KDPXQCSQQHIBIX-FIPMEDRPSA-M |
| InChI | InChI=1S/C63H114NO9P/c1-4-7-10-13-16-19-22-25-27-28-29-30-31-32-34-37-39-42-45-48-51-54-62(66)70-58-60(73-63(67)55-52-49-46-43-40-35-24-21-18-15-12-9-6-3)59-72-74(68,69)71-57-56-64-61(65)53-50-47-44-41-38-36-33-26-23-20-17-14-11-8-5-2/h16,19,25,27,29-30,32,34,40,43,60H,4-15,17-18,20-24,26,28,31,33,35-39,41-42,44-59H2,1-3H3,(H,64,65)(H,68,69)/p-1/b19-16-,27-25-,30-29-,34-32-,43-40-/t60-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCCCCCCCCCCCCC)OC(=O)CCCC/C=C\CCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C63H114NO9P/c1-4-7-10-13-16-19-22-25-27-28-29-30-31-32-34-37-39-42-45-48-51-54-62(66)70-58-60(73-63(67)55-52-49-46-43-40-35-24-21-18-15-12-9-6-3)59-72-74(68,69)71-57-56-64-61(65)53-50-47-44-41-38-36-33-26-23-20-17-14-11-8-5-2/h16,19,25,27,29-30,32,34,40,43,60H,4-15,17-18,20-24,26,28,31,33,35-39,41-42,44-59H2,1-3H3,(H,64,65)(H,68,69)/b19-16-,27-25-,30-29-,34-32-,43-40-/t60-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:27]\[CH2:28]/[CH:29]=[CH:30]\[CH2:31]/[CH:32]=[CH:34]\[CH2:37][CH2:39][CH2:42][CH2:45][CH2:48][CH2:51][CH2:54][C:62](=[O:66])[O:70][CH2:58][C@H:60]([CH2:59][O:72][P:74]([OH:68])(=[O:69])[O:71][CH2:57][CH2:56][N:64]=[C:61]([CH2:53][CH2:50][CH2:47][CH2:44][CH2:41][CH2:38][CH2:36][CH2:33][CH2:26][CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])[OH:65])[O:73][C:63]([CH2:55][CH2:52][CH2:49][CH2:46]/[CH:43]=[CH:40]\[CH2:35][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:67] |
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