| Properties | Image |
|---|
| MNX_ID | MNXM182915 |
 |
| reference | slm:000498330 |
| formula | C63H110NO8P |
| global charge | 0 |
| mol weight | 1040.546 |
| InChIKey | JCOHECWNGWGOFM-JZXZRMMJSA-N |
| InChI | InChI=1S/C63H110NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-24-25-26-27-28-29-30-31-32-33-34-35-36-38-40-42-44-46-48-50-52-54-56-63(66)72-61(60-71-73(67,68)70-58-57-64)59-69-62(65)55-53-51-49-47-45-43-41-39-37-22-20-18-16-14-12-10-8-6-4-2/h11-14,17-20,23-24,26-27,29-30,37,39,61H,3-10,15-16,21-22,25,28,31-36,38,40-60,64H2,1-2H3,(H,67,68)/b13-11-,14-12-,19-17-,20-18-,24-23-,27-26-,30-29-,39-37-/t61-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCC(=O)O[C@H](COC(=O)CCCCCCCC/C=C\C/C=C\C/C=C\CCCCC)COP(=O)([O-])OCC[NH3+] |
MNX internals
| InChI (mnx) | InChI=1/C63H110NO8P/c1-3-5-7-9-11-13-15-17-19-21-23-24-25-26-27-28-29-30-31-32-33-34-35-36-38-40-42-44-46-48-50-52-54-56-63(66)72-61(60-71-73(67,68)70-58-57-64)59-69-62(65)55-53-51-49-47-45-43-41-39-37-22-20-18-16-14-12-10-8-6-4-2/h11-14,17-20,23-24,26-27,29-30,37,39,61H,3-10,15-16,21-22,25,28,31-36,38,40-60,64H2,1-2H3,(H,67,68)/b13-11-,14-12-,19-17-,20-18-,24-23-,27-26-,30-29-,39-37-/t61-/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]/[CH:29]=[CH:30]\[CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][CH2:48][CH2:50][CH2:52][CH2:54][CH2:56][C:63](=[O:66])[O:72][C@H:61]([CH2:59][O:69][C:62]([CH2:55][CH2:53][CH2:51][CH2:49][CH2:47][CH2:45][CH2:43][CH2:41]/[CH:39]=[CH:37]\[CH2:22]/[CH:20]=[CH:18]\[CH2:16]/[CH:14]=[CH:12]\[CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:65])[CH2:60][O:71][P:73]([OH:67])(=[O:68])[O:70][CH2:58][CH2:57][NH2:64] |
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