| Properties | Image |
|---|
| MNX_ID | MNXM199090 |
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| reference | slm:000030809 |
| formula | C39H72NO8P |
| global charge | 0 |
| mol weight | 713.978 |
| InChIKey | WFFGHWAQCWFXLH-NAUAQKTKSA-N |
| InChI | InChI=1S/C39H72NO8P/c1-3-5-7-9-11-13-15-16-17-18-19-20-22-23-25-27-29-31-38(41)45-35-37(36-47-49(43,44)46-34-33-40)48-39(42)32-30-28-26-24-21-14-12-10-8-6-4-2/h5,7,11,13,16-17,37H,3-4,6,8-10,12,14-15,18-36,40H2,1-2H3,(H,43,44)/b7-5-,13-11-,17-16-/t37-/m1/s1 |
| SMILES | CC/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OCC[NH3+])OC(=O)CCCCCCCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C39H72NO8P/c1-3-5-7-9-11-13-15-16-17-18-19-20-22-23-25-27-29-31-38(41)45-35-37(36-47-49(43,44)46-34-33-40)48-39(42)32-30-28-26-24-21-14-12-10-8-6-4-2/h5,7,11,13,16-17,37H,3-4,6,8-10,12,14-15,18-36,40H2,1-2H3,(H,43,44)/b7-5-,13-11-,17-16-/t37-/m1/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3]/[CH:5]=[CH:7]\[CH2:9]/[CH:11]=[CH:13]\[CH2:15]/[CH:16]=[CH:17]\[CH2:18][CH2:19][CH2:20][CH2:22][CH2:23][CH2:25][CH2:27][CH2:29][CH2:31][C:38](=[O:41])[O:45][CH2:35][C@H:37]([CH2:36][O:47][P:49]([OH:43])(=[O:44])[O:46][CH2:34][CH2:33][NH2:40])[O:48][C:39]([CH2:32][CH2:30][CH2:28][CH2:26][CH2:24][CH2:21][CH2:14][CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:42] |
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