| Properties | Image |
|---|
| MNX_ID | MNXM955037 |
 |
| reference | slm:000647422 |
| formula | C62H105NO9P |
| global charge | -1 |
| mol weight | 1039.494 |
| InChIKey | VLBSCVFGGLIDTI-OMOMGKQKSA-M |
| InChI | InChI=1S/C62H106NO9P/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-39-43-47-51-60(64)63-54-55-70-73(67,68)71-57-59(72-62(66)53-49-45-41-37-38-42-46-50-58(3)4)56-69-61(65)52-48-44-40-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2/h7,9,13-16,19-22,25,27,31,33,39,43,58-59H,5-6,8,10-12,17-18,23-24,26,28-30,32,34-38,40-42,44-57H2,1-4H3,(H,63,64)(H,67,68)/p-1/b9-7-,15-13-,16-14-,21-19-,22-20-,27-25-,33-31-,43-39-/t59-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCC(=O)NCCOP(=O)([O-])OC[C@@H](COC(=O)CCCCCCCCCCC/C=C\C/C=C\CCCCC)OC(=O)CCCCCCCCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C62H106NO9P/c1-5-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-39-43-47-51-60(64)63-54-55-70-73(67,68)71-57-59(72-62(66)53-49-45-41-37-38-42-46-50-58(3)4)56-69-61(65)52-48-44-40-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-6-2/h7,9,13-16,19-22,25,27,31,33,39,43,58-59H,5-6,8,10-12,17-18,23-24,26,28-30,32,34-38,40-42,44-57H2,1-4H3,(H,63,64)(H,67,68)/b9-7-,15-13-,16-14-,21-19-,22-20-,27-25-,33-31-,43-39-/t59-/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:19]=[CH:21]\[CH2:23]/[CH:25]=[CH:27]\[CH2:29]/[CH:31]=[CH:33]\[CH2:35]/[CH:39]=[CH:43]\[CH2:47][CH2:51][C:60](=[N:63][CH2:54][CH2:55][O:70][P:73]([OH:67])(=[O:68])[O:71][CH2:57][C@@H:59]([CH2:56][O:69][C:61]([CH2:52][CH2:48][CH2:44][CH2:40][CH2:36][CH2:34][CH2:32][CH2:30][CH2:28][CH2:26][CH2:24]/[CH:22]=[CH:20]\[CH2:18]/[CH:16]=[CH:14]\[CH2:12][CH2:10][CH2:8][CH2:6][CH3:2])=[O:65])[O:72][C:62]([CH2:53][CH2:49][CH2:45][CH2:41][CH2:37][CH2:38][CH2:42][CH2:46][CH2:50][CH:58]([CH3:3])[CH3:4])=[O:66])[OH:64] |
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