| Properties | Image |
|---|
| MNX_ID | MNXM960992 |
 |
| reference | slm:000653377 |
| formula | C62H111NO9P |
| global charge | -1 |
| mol weight | 1045.542 |
| InChIKey | BLOTXRZXUDIERS-RKUABHCMSA-M |
| InChI | InChI=1S/C62H112NO9P/c1-4-7-10-13-16-19-22-25-28-29-30-31-33-36-38-41-44-47-50-53-61(65)69-57-59(72-62(66)54-51-48-45-42-39-35-27-24-21-18-15-12-9-6-3)58-71-73(67,68)70-56-55-63-60(64)52-49-46-43-40-37-34-32-26-23-20-17-14-11-8-5-2/h16,19,25-26,28,30-32,36,38,59H,4-15,17-18,20-24,27,29,33-35,37,39-58H2,1-3H3,(H,63,64)(H,67,68)/p-1/b19-16-,28-25-,31-30-,32-26-,38-36-/t59-/m1/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCCCCC/C=C\CCCCCCCC)OC(=O)CCCCCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C62H112NO9P/c1-4-7-10-13-16-19-22-25-28-29-30-31-33-36-38-41-44-47-50-53-61(65)69-57-59(72-62(66)54-51-48-45-42-39-35-27-24-21-18-15-12-9-6-3)58-71-73(67,68)70-56-55-63-60(64)52-49-46-43-40-37-34-32-26-23-20-17-14-11-8-5-2/h16,19,25-26,28,30-32,36,38,59H,4-15,17-18,20-24,27,29,33-35,37,39-58H2,1-3H3,(H,63,64)(H,67,68)/b19-16-,28-25-,31-30-,32-26-,38-36-/t59-/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:28]\[CH2:29]/[CH:30]=[CH:31]\[CH2:33]/[CH:36]=[CH:38]\[CH2:41][CH2:44][CH2:47][CH2:50][CH2:53][C:61](=[O:65])[O:69][CH2:57][C@H:59]([CH2:58][O:71][P:73]([OH:67])(=[O:68])[O:70][CH2:56][CH2:55][N:63]=[C:60]([CH2:52][CH2:49][CH2:46][CH2:43][CH2:40][CH2:37][CH2:34]/[CH:32]=[CH:26]\[CH2:23][CH2:20][CH2:17][CH2:14][CH2:11][CH2:8][CH2:5][CH3:2])[OH:64])[O:72][C:62]([CH2:54][CH2:51][CH2:48][CH2:45][CH2:42][CH2:39][CH2:35][CH2:27][CH2:24][CH2:21][CH2:18][CH2:15][CH2:12][CH2:9][CH2:6][CH3:3])=[O:66] |
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