| Properties | Image |
|---|
| MNX_ID | MNXM962345 |
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| reference | slm:000654730 |
| formula | C63H103NO9P |
| global charge | -1 |
| mol weight | 1049.489 |
| InChIKey | MORACEYXOQEVPL-ZBOWPNPDSA-M |
| InChI | InChI=1S/C63H104NO9P/c1-4-7-10-13-16-18-20-22-24-26-28-29-30-31-33-35-37-39-41-43-46-48-51-54-62(66)70-58-60(73-63(67)55-52-49-44-15-12-9-6-3)59-72-74(68,69)71-57-56-64-61(65)53-50-47-45-42-40-38-36-34-32-27-25-23-21-19-17-14-11-8-5-2/h8,11,16-19,22-25,28-29,31-34,38,40,45,47,60H,4-7,9-10,12-15,20-21,26-27,30,35-37,39,41-44,46,48-59H2,1-3H3,(H,64,65)(H,68,69)/p-1/b11-8-,18-16-,19-17-,24-22-,25-23-,29-28-,33-31-,34-32-,40-38-,47-45-/t60-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)NCCOP(=O)([O-])OC[C@@H](COC(=O)CCCCCCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C63H104NO9P/c1-4-7-10-13-16-18-20-22-24-26-28-29-30-31-33-35-37-39-41-43-46-48-51-54-62(66)70-58-60(73-63(67)55-52-49-44-15-12-9-6-3)59-72-74(68,69)71-57-56-64-61(65)53-50-47-45-42-40-38-36-34-32-27-25-23-21-19-17-14-11-8-5-2/h8,11,16-19,22-25,28-29,31-34,38,40,45,47,60H,4-7,9-10,12-15,20-21,26-27,30,35-37,39,41-44,46,48-59H2,1-3H3,(H,64,65)(H,68,69)/b11-8-,18-16-,19-17-,24-22-,25-23-,29-28-,33-31-,34-32-,40-38-,47-45-/t60-/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:24]\[CH2:26]/[CH:28]=[CH:29]\[CH2:30]/[CH:31]=[CH:33]\[CH2:35][CH2:37][CH2:39][CH2:41][CH2:43][CH2:46][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]/[CH:47]=[CH:45]\[CH2:42]/[CH:40]=[CH:38]\[CH2:36]/[CH:34]=[CH:32]\[CH2:27]/[CH:25]=[CH:23]\[CH2:21]/[CH:19]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])[OH:65])[O:73][C:63]([CH2:55][CH2:52][CH2:49][CH2:44][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:67] |
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