| Properties | Image |
|---|
| MNX_ID | MNXM1370047 |
 |
| reference | keggC:C21527 |
| formula | C56H82O2 |
| global charge | 0 |
| mol weight | 787.27 |
| InChIKey | SJOKRFJLUXNKIK-ISIUCFNPSA-N |
| InChI | InChI=1S/C56H82O2/c1-42(2)22-14-23-43(3)24-15-25-44(4)26-16-27-45(5)28-17-29-46(6)30-18-31-47(7)32-19-33-48(8)34-20-35-49(9)36-21-37-50(10)40-41-52-51(11)55(57)53-38-12-13-39-54(53)56(52)58/h12-13,22,24,26,28,30,32,34,38-40,49H,14-21,23,25,27,29,31,33,35-37,41H2,1-11H3/b43-24+,44-26+,45-28+,46-30+,47-32+,48-34+,50-40+ |
| 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/CCC(C)CCC/C(C)=C/CC1=C(C)C(=O)C2=CC=CC=C2C1=O |
MNX internals
| InChI (mnx) | InChI=1/C56H82O2/c1-42(2)22-14-23-43(3)24-15-25-44(4)26-16-27-45(5)28-17-29-46(6)30-18-31-47(7)32-19-33-48(8)34-20-35-49(9)36-21-37-50(10)40-41-52-51(11)55(57)53-38-12-13-39-54(53)56(52)58/h12-13,22,24,26,28,30,32,34,38-40,49H,14-21,23,25,27,29,31,33,35-37,41H2,1-11H3/b43-24+,44-26+,45-28+,46-30+,47-32+,48-34+,50-40+/t49? |
 |
| SMILES (mnx) | [CH3:1][C:42]([CH3:2])=[CH:22][CH2:14][CH2:23]/[C:43]([CH3:3])=[CH:24]/[CH2:15][CH2:25]/[C:44]([CH3:4])=[CH:26]/[CH2:16][CH2:27]/[C:45]([CH3:5])=[CH:28]/[CH2:17][CH2:29]/[C:46]([CH3:6])=[CH:30]/[CH2:18][CH2:31]/[C:47]([CH3:7])=[CH:32]/[CH2:19][CH2:33]/[C:48]([CH3:8])=[CH:34]/[CH2:20][CH2:35][CH:49]([CH3:9])[CH2:36][CH2:21][CH2:37]/[C:50]([CH3:10])=[CH:40]/[CH2:41][C:52]1=[C:51]([CH3:11])[C:55](=[O:57])[C:53]2=[CH:38][CH:12]=[CH:13][CH:39]=[C:54]2[C:56]1=[O:58] |
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