| Properties | Image |
|---|
| MNX_ID | MNXM190313 |
 |
| reference | slm:000471146 |
| formula | C48H89O13P2 |
| global charge | -3 |
| mol weight | 936.175 |
| InChIKey | KVDBDXLCBMXOGM-XDDJJUGXSA-K |
| InChI | InChI=1S/C48H92O13P2/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-26-28-30-32-34-36-38-40-48(51)61-46(44-60-63(55,56)59-42-45(49)41-58-62(52,53)54)43-57-47(50)39-37-35-33-31-29-27-25-18-16-14-12-10-8-6-4-2/h14,16-17,19,45-46,49H,3-13,15,18,20-44H2,1-2H3,(H,55,56)(H2,52,53,54)/p-3/b16-14+,19-17-/t45-,46+/m0/s1 |
| SMILES | CCCCCC/C=C/CCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@@H](O)COP(=O)([O-])[O-])OC(=O)CCCCCCCCCCCCC/C=C\CCCCCCCC |
MNX internals
| InChI (mnx) | InChI=1/C48H92O13P2/c1-3-5-7-9-11-13-15-17-19-20-21-22-23-24-26-28-30-32-34-36-38-40-48(51)61-46(44-60-63(55,56)59-42-45(49)41-58-62(52,53)54)43-57-47(50)39-37-35-33-31-29-27-25-18-16-14-12-10-8-6-4-2/h14,16-17,19,45-46,49H,3-13,15,18,20-44H2,1-2H3,(H,55,56)(H2,52,53,54)/b16-14+,19-17-/t45-,46+/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:3][CH2:5][CH2:7][CH2:9][CH2:11][CH2:13][CH2:15]/[CH:17]=[CH:19]\[CH2:20][CH2:21][CH2:22][CH2:23][CH2:24][CH2:26][CH2:28][CH2:30][CH2:32][CH2:34][CH2:36][CH2:38][CH2:40][C:48](=[O:51])[O:61][C@H:46]([CH2:43][O:57][C:47]([CH2:39][CH2:37][CH2:35][CH2:33][CH2:31][CH2:29][CH2:27][CH2:25][CH2:18]/[CH:16]=[CH:14]/[CH2:12][CH2:10][CH2:8][CH2:6][CH2:4][CH3:2])=[O:50])[CH2:44][O:60][P:63]([OH:55])(=[O:56])[O:59][CH2:42][C@H:45]([CH2:41][O:58][P:62]([OH:52])([OH:53])=[O:54])[OH:49] |
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