| Properties | Image |
|---|
| MNX_ID | MNXM346761 |
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| reference | slm:000035179 |
| formula | C57H106NO8P |
| global charge | 0 |
| mol weight | 964.448 |
| InChIKey | QNBISGMGPIUYCA-UQXUOHFXSA-N |
| InChI | InChI=1S/C57H106NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-24-25-26-27-28-29-30-32-34-36-38-40-42-44-46-48-50-57(60)66-55(54-65-67(61,62)64-52-51-58)53-63-56(59)49-47-45-43-41-39-37-35-33-31-22-20-18-16-14-12-10-8-6-4-2/h11,13,17,19,23-24,26-27,55H,3-10,12,14-16,18,20-22,25,28-54,58H2,1-2H3,(H,61,62)/b13-11-,19-17-,24-23-,27-26-/t55-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCCCCCCCCCCCCCCC)COP(=O)([O-])OCC[NH3+] |
MNX internals
| InChI (mnx) | InChI=1/C57H106NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-24-25-26-27-28-29-30-32-34-36-38-40-42-44-46-48-50-57(60)66-55(54-65-67(61,62)64-52-51-58)53-63-56(59)49-47-45-43-41-39-37-35-33-31-22-20-18-16-14-12-10-8-6-4-2/h11,13,17,19,23-24,26-27,55H,3-10,12,14-16,18,20-22,25,28-54,58H2,1-2H3,(H,61,62)/b13-11-,19-17-,24-23-,27-26-/t55-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:17]=[CH:19]\[CH2:21]/[CH:23]=[CH:24]\[CH2:25]/[CH:26]=[CH:27]\[CH2:28][CH2:29][CH2:30][CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][CH2:48][CH2:50][C:57](=[O:60])[O:66][C@H:55]([CH2:53][O:63][C:56]([CH2:49][CH2:47][CH2:45][CH2:43][CH2:41][CH2:39][CH2:37][CH2:35][CH2:33][CH2:31][CH2:22][CH2:20][CH2:18][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:59])[CH2:54][O:65][P:67]([OH:61])(=[O:62])[O:64][CH2:52][CH2:51][NH2:58] |
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