| Properties | Image |
|---|
| MNX_ID | MNXM194387 |
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| reference | slm:000037054 |
| formula | C45H80O10P |
| global charge | -1 |
| mol weight | 812.099 |
| InChIKey | RMNIJCGQCJGNSO-AJCOIIBZSA-M |
| InChI | InChI=1S/C45H81O10P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26-29-32-35-44(48)52-39-43(40-54-56(50,51)53-38-42(47)37-46)55-45(49)36-33-30-27-24-25-28-31-34-41(2)3/h8-9,11-12,14-15,17-18,41-43,46-47H,4-7,10,13,16,19-40H2,1-3H3,(H,50,51)/p-1/b9-8-,12-11-,15-14-,18-17-/t42-,43+/m0/s1 |
| SMILES | CCCCC/C=C\C/C=C\C/C=C\C/C=C\CCCCCCCCCC(=O)OC[C@H](COP(=O)([O-])OC[C@@H](O)CO)OC(=O)CCCCCCCCCC(C)C |
MNX internals
| InChI (mnx) | InChI=1/C45H81O10P/c1-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-26-29-32-35-44(48)52-39-43(40-54-56(50,51)53-38-42(47)37-46)55-45(49)36-33-30-27-24-25-28-31-34-41(2)3/h8-9,11-12,14-15,17-18,41-43,46-47H,4-7,10,13,16,19-40H2,1-3H3,(H,50,51)/b9-8-,12-11-,15-14-,18-17-/t42-,43+/m0/s1 |
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| SMILES (mnx) | [CH3:1][CH2:4][CH2:5][CH2:6][CH2:7]/[CH:8]=[CH:9]\[CH2:10]/[CH:11]=[CH:12]\[CH2:13]/[CH:14]=[CH:15]\[CH2:16]/[CH:17]=[CH:18]\[CH2:19][CH2:20][CH2:21][CH2:22][CH2:23][CH2:26][CH2:29][CH2:32][CH2:35][C:44](=[O:48])[O:52][CH2:39][C@H:43]([CH2:40][O:54][P:56]([OH:50])(=[O:51])[O:53][CH2:38][C@H:42]([CH2:37][OH:46])[OH:47])[O:55][C:45]([CH2:36][CH2:33][CH2:30][CH2:27][CH2:24][CH2:25][CH2:28][CH2:31][CH2:34][CH:41]([CH3:2])[CH3:3])=[O:49] |
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