| Properties | Image |
|---|
| MNX_ID | MNXM726928 |
 |
| reference | chebi:53041 |
| formula | C60H100O7P2 |
| global charge | 0 |
| mol weight | 995.401 |
| InChIKey | WURMRKUXTPWSRM-UHFFFAOYSA-N |
| InChI | InChI=1S/C60H100O7P2/c1-49(2)25-14-26-50(3)27-15-28-51(4)29-16-30-52(5)31-17-32-53(6)33-18-34-54(7)35-19-36-55(8)37-20-38-56(9)39-21-40-57(10)41-22-42-58(11)43-23-44-59(12)45-24-46-60(13)47-48-66-69(64,65)67-68(61,62)63/h25,27,29,31,33,35,37,39,41,43,45,47H,14-24,26,28,30,32,34,36,38,40,42,44,46,48H2,1-13H3,(H,64,65)(H2,61,62,63) |
| SMILES | CC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCCC(C)=CCOP(=O)(O)OP(=O)(O)O |
MNX internals
| InChI (mnx) | InChI=1/C60H100O7P2/c1-49(2)25-14-26-50(3)27-15-28-51(4)29-16-30-52(5)31-17-32-53(6)33-18-34-54(7)35-19-36-55(8)37-20-38-56(9)39-21-40-57(10)41-22-42-58(11)43-23-44-59(12)45-24-46-60(13)47-48-66-69(64,65)67-68(61,62)63/h25,27,29,31,33,35,37,39,41,43,45,47H,14-24,26,28,30,32,34,36,38,40,42,44,46,48H2,1-13H3,(H,64,65)(H2,61,62,63)/b50-27?,51-29?,52-31?,53-33?,54-35?,55-37?,56-39?,57-41?,58-43?,59-45?,60-47? |
 |
| SMILES (mnx) | [CH3:1][C:49]([CH3:2])=[CH:25][CH2:14][CH2:26][C:50]([CH3:3])=[CH:27][CH2:15][CH2:28][C:51]([CH3:4])=[CH:29][CH2:16][CH2:30][C:52]([CH3:5])=[CH:31][CH2:17][CH2:32][C:53]([CH3:6])=[CH:33][CH2:18][CH2:34][C:54]([CH3:7])=[CH:35][CH2:19][CH2:36][C:55]([CH3:8])=[CH:37][CH2:20][CH2:38][C:56]([CH3:9])=[CH:39][CH2:21][CH2:40][C:57]([CH3:10])=[CH:41][CH2:22][CH2:42][C:58]([CH3:11])=[CH:43][CH2:23][CH2:44][C:59]([CH3:12])=[CH:45][CH2:24][CH2:46][C:60]([CH3:13])=[CH:47][CH2:48][O:66][P:69]([OH:64])(=[O:65])[O:67][P:68]([OH:61])([OH:62])=[O:63] |
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