| Properties | Image |
|---|
| MNX_ID | MNXM938771 |
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| reference | slm:000631156 |
| formula | C62H105NO9P |
| global charge | -1 |
| mol weight | 1039.494 |
| InChIKey | SVWQABOJCNIBKA-TXPXPBCLSA-M |
| InChI | InChI=1S/C62H106NO9P/c1-4-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-40-42-44-46-48-50-52-54-62(66)69-57-59(72-61(65)6-3)58-71-73(67,68)70-56-55-63-60(64)53-51-49-47-45-43-41-39-20-18-16-14-12-10-8-5-2/h7,9,13-16,19-21,23-24,26-27,39,43,45,59H,4-6,8,10-12,17-18,22,25,28-38,40-42,44,46-58H2,1-3H3,(H,63,64)(H,67,68)/p-1/b9-7-,15-13-,16-14-,21-19-,24-23-,27-26-,39-20-,45-43-/t59-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCCCCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCCNC(=O)CCCC/C=C\C/C=C\C/C=C\CCCCC)OC(=O)CC |
MNX internals
| InChI (mnx) | InChI=1/C62H106NO9P/c1-4-7-9-11-13-15-17-19-21-22-23-24-25-26-27-28-29-30-31-32-33-34-35-36-37-38-40-42-44-46-48-50-52-54-62(66)69-57-59(72-61(65)6-3)58-71-73(67,68)70-56-55-63-60(64)53-51-49-47-45-43-41-39-20-18-16-14-12-10-8-5-2/h7,9,13-16,19-21,23-24,26-27,39,43,45,59H,4-6,8,10-12,17-18,22,25,28-38,40-42,44,46-58H2,1-3H3,(H,63,64)(H,67,68)/b9-7-,15-13-,16-14-,21-19-,24-23-,27-26-,39-20-,45-43-/t59-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4]/[CH:7]=[CH:9]\[CH2:11]/[CH:13]=[CH:15]\[CH2:17]/[CH:19]=[CH:21]\[CH2:22]/[CH:23]=[CH:24]\[CH2:25]/[CH:26]=[CH:27]\[CH2:28][CH2:29][CH2:30][CH2:31][CH2:32][CH2:33][CH2:34][CH2:35][CH2:36][CH2:37][CH2:38][CH2:40][CH2:42][CH2:44][CH2:46][CH2:48][CH2:50][CH2:52][CH2:54][C:62](=[O:66])[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]([CH2:53][CH2:51][CH2:49][CH2:47]/[CH:45]=[CH:43]\[CH2:41]/[CH:39]=[CH:20]\[CH2:18]/[CH:16]=[CH:14]\[CH2:12][CH2:10][CH2:8][CH2:5][CH3:2])[OH:64])[O:72][C:61]([CH2:6][CH3:3])=[O:65] |
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