| Properties | Image |
|---|
| MNX_ID | MNXM1025374 |
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| reference | slm:000717763 |
| formula | C63H111NO8P |
| global charge | -1 |
| mol weight | 1041.554 |
| InChIKey | JLOXIAFMJWSDAU-JFRVTCEYSA-M |
| InChI | InChI=1S/C63H112NO8P/c1-4-7-10-13-16-19-22-25-27-29-30-31-32-33-34-37-40-43-46-49-52-55-63(66)72-61(59-69-57-53-50-47-44-41-38-35-28-26-23-20-17-14-11-8-5-2)60-71-73(67,68)70-58-56-64-62(65)54-51-48-45-42-39-36-24-21-18-15-12-9-6-3/h14,16-17,19,25,27,30-31,33-34,40,43,53,57,61H,4-13,15,18,20-24,26,28-29,32,35-39,41-42,44-52,54-56,58-60H2,1-3H3,(H,64,65)(H,67,68)/p-1/b17-14-,19-16-,27-25-,31-30-,34-33-,43-40-,57-53-/t61-/m1/s1 |
| SMILES | CCCC/C=C\CCCCCCCCCC/C=C\OC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCCCCCCCCCCC)OC(=O)CCCC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCC |
MNX internals
| InChI (mnx) | InChI=1/C63H112NO8P/c1-4-7-10-13-16-19-22-25-27-29-30-31-32-33-34-37-40-43-46-49-52-55-63(66)72-61(59-69-57-53-50-47-44-41-38-35-28-26-23-20-17-14-11-8-5-2)60-71-73(67,68)70-58-56-64-62(65)54-51-48-45-42-39-36-24-21-18-15-12-9-6-3/h14,16-17,19,25,27,30-31,33-34,40,43,53,57,61H,4-13,15,18,20-24,26,28-29,32,35-39,41-42,44-52,54-56,58-60H2,1-3H3,(H,64,65)(H,67,68)/b17-14-,19-16-,27-25-,31-30-,34-33-,43-40-,57-53-/t61-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:7][CH2:10][CH2:13]/[CH:16]=[CH:19]\[CH2:22]/[CH:25]=[CH:27]\[CH2:29]/[CH:30]=[CH:31]\[CH2:32]/[CH:33]=[CH:34]\[CH2:37]/[CH:40]=[CH:43]\[CH2:46][CH2:49][CH2:52][CH2:55][C:63](=[O:66])[O:72][C@H:61]([CH2:59][O:69]/[CH:57]=[CH:53]\[CH2:50][CH2:47][CH2:44][CH2:41][CH2:38][CH2:35][CH2:28][CH2:26][CH2:23][CH2:20]/[CH:17]=[CH:14]\[CH2:11][CH2:8][CH2:5][CH3:2])[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][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])[OH:65] |
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