| Properties | Image |
|---|
| MNX_ID | MNXM966384 |
 |
| reference | slm:000658769 |
| formula | C63H109NO9P |
| global charge | -1 |
| mol weight | 1055.537 |
| InChIKey | PIGGXKMFHNFIDB-BCRFEWEASA-M |
| InChI | InChI=1S/C63H110NO9P/c1-4-7-10-13-15-17-19-21-23-24-25-26-27-28-29-30-31-32-33-34-35-36-38-39-41-43-45-48-51-54-62(66)70-58-60(59-72-74(68,69)71-57-56-64-61(65)53-50-47-12-9-6-3)73-63(67)55-52-49-46-44-42-40-37-22-20-18-16-14-11-8-5-2/h15-18,21-23,25-26,28-29,37,42,44,60H,4-14,19-20,24,27,30-36,38-41,43,45-59H2,1-3H3,(H,64,65)(H,68,69)/p-1/b17-15-,18-16-,23-21-,26-25-,29-28-,37-22-,44-42-/t60-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCCC)OC(=O)CCCC/C=C\C/C=C\C/C=C\CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C63H110NO9P/c1-4-7-10-13-15-17-19-21-23-24-25-26-27-28-29-30-31-32-33-34-35-36-38-39-41-43-45-48-51-54-62(66)70-58-60(59-72-74(68,69)71-57-56-64-61(65)53-50-47-12-9-6-3)73-63(67)55-52-49-46-44-42-40-37-22-20-18-16-14-11-8-5-2/h15-18,21-23,25-26,28-29,37,42,44,60H,4-14,19-20,24,27,30-36,38-41,43,45-59H2,1-3H3,(H,64,65)(H,68,69)/b17-15-,18-16-,23-21-,26-25-,29-28-,37-22-,44-42-/t60-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:15]=[CH:17]\[CH2:19]/[CH:21]=[CH:23]\[CH2:24]/[CH:25]=[CH:26]\[CH2:27]/[CH:28]=[CH:29]\[CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:38][CH2:39][CH2:41][CH2:43][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][CH2:12][CH2:9][CH2:6][CH3:3])[OH:65])[O:73][C:63]([CH2:55][CH2:52][CH2:49][CH2:46]/[CH:44]=[CH:42]\[CH2:40]/[CH:37]=[CH:22]\[CH2:20]/[CH:18]=[CH:16]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:67] |
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