| Properties | Image |
|---|
| MNX_ID | MNXM964046 |
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| reference | slm:000656431 |
| formula | C61H105NO9P |
| global charge | -1 |
| mol weight | 1027.483 |
| InChIKey | FMVMSCDGEHCWHC-RSGRXMJTSA-M |
| InChI | InChI=1S/C61H106NO9P/c1-4-7-10-13-15-17-19-21-23-25-26-27-28-29-30-31-32-34-35-37-39-41-43-46-49-52-60(64)68-56-58(57-70-72(66,67)69-55-54-62-59(63)51-48-45-12-9-6-3)71-61(65)53-50-47-44-42-40-38-36-33-24-22-20-18-16-14-11-8-5-2/h15-18,21-24,26-27,29-30,36,38,58H,4-14,19-20,25,28,31-35,37,39-57H2,1-3H3,(H,62,63)(H,66,67)/p-1/b17-15-,18-16-,23-21-,24-22-,27-26-,30-29-,38-36-/t58-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCCC)OC(=O)CCCCCC/C=C\C/C=C\C/C=C\CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C61H106NO9P/c1-4-7-10-13-15-17-19-21-23-25-26-27-28-29-30-31-32-34-35-37-39-41-43-46-49-52-60(64)68-56-58(57-70-72(66,67)69-55-54-62-59(63)51-48-45-12-9-6-3)71-61(65)53-50-47-44-42-40-38-36-33-24-22-20-18-16-14-11-8-5-2/h15-18,21-24,26-27,29-30,36,38,58H,4-14,19-20,25,28,31-35,37,39-57H2,1-3H3,(H,62,63)(H,66,67)/b17-15-,18-16-,23-21-,24-22-,27-26-,30-29-,38-36-/t58-/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]\[CH2:25]/[CH:26]=[CH:27]\[CH2:28]/[CH:29]=[CH:30]\[CH2:31][CH2:32][CH2:34][CH2:35][CH2:37][CH2:39][CH2:41][CH2:43][CH2:46][CH2:49][CH2:52][C:60](=[O:64])[O:68][CH2:56][C@H:58]([CH2:57][O:70][P:72]([OH:66])(=[O:67])[O:69][CH2:55][CH2:54][N:62]=[C:59]([CH2:51][CH2:48][CH2:45][CH2:12][CH2:9][CH2:6][CH3:3])[OH:63])[O:71][C:61]([CH2:53][CH2:50][CH2:47][CH2:44][CH2:42][CH2:40]/[CH:38]=[CH:36]\[CH2:33]/[CH:24]=[CH:22]\[CH2:20]/[CH:18]=[CH:16]\[CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])=[O:65] |
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