| Properties | Image |
|---|
| MNX_ID | MNXM147079 |
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| reference | chebi:60385 |
| formula | C65H105O7P2 |
| global charge | -3 |
| mol weight | 1060.496 |
| InChIKey | DZNALTJEOIIEJL-AIPXUUHZSA-K |
| InChI | InChI=1S/C65H108O7P2/c1-53(2)27-15-28-54(3)29-16-30-55(4)31-17-32-56(5)33-18-34-57(6)35-19-36-58(7)37-20-38-59(8)39-21-40-60(9)41-22-42-61(10)43-23-44-62(11)45-24-46-63(12)47-25-48-64(13)49-26-50-65(14)51-52-71-74(69,70)72-73(66,67)68/h27,29,31,33,35,37,39,41,43,45,47,49,51H,15-26,28,30,32,34,36,38,40,42,44,46,48,50,52H2,1-14H3,(H,69,70)(H2,66,67,68)/p-3/b54-29+,55-31+,56-33-,57-35-,58-37-,59-39-,60-41-,61-43-,62-45-,63-47-,64-49-,65-51- |
| SMILES | CC(C)=CCC/C(C)=C/CC/C(C)=C/CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\CC/C(C)=C\COP(=O)([O-])OP(=O)([O-])[O-] |
MNX internals
| InChI (mnx) | InChI=1/C65H108O7P2/c1-53(2)27-15-28-54(3)29-16-30-55(4)31-17-32-56(5)33-18-34-57(6)35-19-36-58(7)37-20-38-59(8)39-21-40-60(9)41-22-42-61(10)43-23-44-62(11)45-24-46-63(12)47-25-48-64(13)49-26-50-65(14)51-52-71-74(69,70)72-73(66,67)68/h27,29,31,33,35,37,39,41,43,45,47,49,51H,15-26,28,30,32,34,36,38,40,42,44,46,48,50,52H2,1-14H3,(H,69,70)(H2,66,67,68)/b54-29+,55-31+,56-33-,57-35-,58-37-,59-39-,60-41-,61-43-,62-45-,63-47-,64-49-,65-51- |
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| SMILES (mnx) | [CH3:1][C:53]([CH3:2])=[CH:27][CH2:15][CH2:28]/[C:54]([CH3:3])=[CH:29]/[CH2:16][CH2:30]/[C:55]([CH3:4])=[CH:31]/[CH2:17][CH2:32]/[C:56]([CH3:5])=[CH:33]\[CH2:18][CH2:34]/[C:57]([CH3:6])=[CH:35]\[CH2:19][CH2:36]/[C:58]([CH3:7])=[CH:37]\[CH2:20][CH2:38]/[C:59]([CH3:8])=[CH:39]\[CH2:21][CH2:40]/[C:60]([CH3:9])=[CH:41]\[CH2:22][CH2:42]/[C:61]([CH3:10])=[CH:43]\[CH2:23][CH2:44]/[C:62]([CH3:11])=[CH:45]\[CH2:24][CH2:46]/[C:63]([CH3:12])=[CH:47]\[CH2:25][CH2:48]/[C:64]([CH3:13])=[CH:49]\[CH2:26][CH2:50]/[C:65]([CH3:14])=[CH:51]\[CH2:52][O:71][P:74]([OH:69])(=[O:70])[O:72][P:73]([OH:66])([OH:67])=[O:68] |
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