| Properties | Image |
|---|
| MNX_ID | MNXM1033110 |
 |
| reference | slm:000725499 |
| formula | C63H113NO8P |
| global charge | -1 |
| mol weight | 1043.57 |
| InChIKey | DAVIAJMVVRXIJP-WGMLVBSSSA-M |
| InChI | InChI=1S/C63H114NO8P/c1-4-7-10-13-16-19-22-25-28-30-32-35-38-41-44-47-50-53-57-69-59-61(72-63(66)55-52-49-46-43-40-37-34-31-29-26-23-20-17-14-11-8-5-2)60-71-73(67,68)70-58-56-64-62(65)54-51-48-45-42-39-36-33-27-24-21-18-15-12-9-6-3/h8,11,17,20,26-27,29,33-34,37,43,46,61H,4-7,9-10,12-16,18-19,21-25,28,30-32,35-36,38-42,44-45,47-60H2,1-3H3,(H,64,65)(H,67,68)/p-1/b11-8-,20-17-,29-26-,33-27-,37-34-,46-43-/t61-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCC(=O)O[C@H](COCCCCCCCCCCCCCCCCCCCC)COP(=O)([O-])OCCNC(=O)CCCCCCC/C=C\CCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C63H114NO8P/c1-4-7-10-13-16-19-22-25-28-30-32-35-38-41-44-47-50-53-57-69-59-61(72-63(66)55-52-49-46-43-40-37-34-31-29-26-23-20-17-14-11-8-5-2)60-71-73(67,68)70-58-56-64-62(65)54-51-48-45-42-39-36-33-27-24-21-18-15-12-9-6-3/h8,11,17,20,26-27,29,33-34,37,43,46,61H,4-7,9-10,12-16,18-19,21-25,28,30-32,35-36,38-42,44-45,47-60H2,1-3H3,(H,64,65)(H,67,68)/b11-8-,20-17-,29-26-,33-27-,37-34-,46-43-/t61-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13][CH2:16][CH2:19][CH2:22][CH2:25][CH2:28][CH2:30][CH2:32][CH2:35][CH2:38][CH2:41][CH2:44][CH2:47][CH2:50][CH2:53][CH2:57][O:69][CH2:59][C@H:61]([CH2:60][O:71][P:73]([OH:67])(=[O:68])[O:70][CH2:58][CH2:56][N:64]=[C:62]([CH2:54][CH2:51][CH2:48][CH2:45][CH2:42][CH2:39][CH2:36]/[CH:33]=[CH:27]\[CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:65])[O:72][C:63]([CH2:55][CH2:52][CH2:49]/[CH:46]=[CH:43]\[CH2:40]/[CH:37]=[CH:34]\[CH2:31]/[CH:29]=[CH:26]\[CH2:23]/[CH:20]=[CH:17]\[CH2:14]/[CH:11]=[CH:8]\[CH2:5][CH3:2])=[O:66] |
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