| Properties | Image |
|---|
| MNX_ID | MNXM965796 |
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| reference | slm:000658181 |
| formula | C47H83NO9P |
| global charge | -1 |
| mol weight | 837.153 |
| InChIKey | FVKDAWYJTOCACW-QFPLKGEMSA-M |
| InChI | InChI=1S/C47H84NO9P/c1-4-6-8-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-35-37-39-47(51)54-42-45(57-44(3)49)43-56-58(52,53)55-41-40-48-46(50)38-36-34-9-7-5-2/h11-12,14-15,17-18,20-21,45H,4-10,13,16,19,22-43H2,1-3H3,(H,48,50)(H,52,53)/p-1/b12-11-,15-14-,18-17-,21-20-/t45-/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(C)=O |
MNX internals
| InChI (mnx) | InChI=1/C47H84NO9P/c1-4-6-8-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-25-26-27-28-29-30-31-32-33-35-37-39-47(51)54-42-45(57-44(3)49)43-56-58(52,53)55-41-40-48-46(50)38-36-34-9-7-5-2/h11-12,14-15,17-18,20-21,45H,4-10,13,16,19,22-43H2,1-3H3,(H,48,50)(H,52,53)/b12-11-,15-14-,18-17-,21-20-/t45-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:6][CH2:8][CH2:10]/[CH:11]=[CH:12]\[CH2:13]/[CH:14]=[CH:15]\[CH2:16]/[CH:17]=[CH:18]\[CH2:19]/[CH:20]=[CH:21]\[CH2:22][CH2:23][CH2:24][CH2:25][CH2:26][CH2:27][CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:35][CH2:37][CH2:39][C:47](=[O:51])[O:54][CH2:42][C@H:45]([CH2:43][O:56][P:58]([OH:52])(=[O:53])[O:55][CH2:41][CH2:40][N:48]=[C:46]([CH2:38][CH2:36][CH2:34][CH2:9][CH2:7][CH2:5][CH3:2])[OH:50])[O:57][C:44]([CH3:3])=[O:49] |
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