| Properties | Image |
|---|
| MNX_ID | MNXM1028369 |
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| reference | slm:000720758 |
| formula | C52H95NO8P |
| global charge | -1 |
| mol weight | 893.305 |
| InChIKey | FVKDRKLPZZKYKP-NUYURLSTSA-M |
| InChI | InChI=1S/C52H96NO8P/c1-5-7-9-11-13-15-17-18-19-20-22-27-31-35-39-43-52(55)61-50(47-58-45-40-36-32-28-24-23-25-29-33-37-41-49(3)4)48-60-62(56,57)59-46-44-53-51(54)42-38-34-30-26-21-16-14-12-10-8-6-2/h7,9,13,15,18-19,22,27,49-50H,5-6,8,10-12,14,16-17,20-21,23-26,28-48H2,1-4H3,(H,53,54)(H,56,57)/p-1/b9-7-,15-13-,19-18-,27-22-/t50-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\CCCCC(=O)O[C@H](COCCCCCCCCCCCCC(C)C)COP(=O)([O-])OCCNC(=O)CCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C52H96NO8P/c1-5-7-9-11-13-15-17-18-19-20-22-27-31-35-39-43-52(55)61-50(47-58-45-40-36-32-28-24-23-25-29-33-37-41-49(3)4)48-60-62(56,57)59-46-44-53-51(54)42-38-34-30-26-21-16-14-12-10-8-6-2/h7,9,13,15,18-19,22,27,49-50H,5-6,8,10-12,14,16-17,20-21,23-26,28-48H2,1-4H3,(H,53,54)(H,56,57)/b9-7-,15-13-,19-18-,27-22-/t50-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:5]/[CH:7]=[CH:9]\[CH2:11]/[CH:13]=[CH:15]\[CH2:17]/[CH:18]=[CH:19]\[CH2:20]/[CH:22]=[CH:27]\[CH2:31][CH2:35][CH2:39][CH2:43][C:52](=[O:55])[O:61][C@H:50]([CH2:47][O:58][CH2:45][CH2:40][CH2:36][CH2:32][CH2:28][CH2:24][CH2:23][CH2:25][CH2:29][CH2:33][CH2:37][CH2:41][CH:49]([CH3:3])[CH3:4])[CH2:48][O:60][P:62]([OH:56])(=[O:57])[O:59][CH2:46][CH2:44][N:53]=[C:51]([CH2:42][CH2:38][CH2:34][CH2:30][CH2:26][CH2:21][CH2:16][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])[OH:54] |
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