| Properties | Image |
|---|
| MNX_ID | MNXM109048 |
 |
| reference | chebi:69434 |
| formula | C31H50O2 |
| global charge | 0 |
| mol weight | 454.739 |
| InChIKey | IZEUIYYDWBKERE-ZRODXFKISA-N |
| InChI | InChI=1S/C31H50O2/c1-8-23(20(2)3)10-9-21(4)27-13-14-28-26-12-11-24-19-25(33-22(5)32)15-17-30(24,6)29(26)16-18-31(27,28)7/h9-11,20-21,23,25-29H,8,12-19H2,1-7H3/b10-9+/t21-,23-,25+,26+,27-,28+,29+,30+,31-/m1/s1 |
| SMILES | CC[C@H](/C=C/[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](OC(C)=O)CC[C@]4(C)[C@H]3CC[C@]12C)C(C)C |
MNX internals
| InChI (mnx) | InChI=1/C31H50O2/c1-8-23(20(2)3)10-9-21(4)27-13-14-28-26-12-11-24-19-25(33-22(5)32)15-17-30(24,6)29(26)16-18-31(27,28)7/h9-11,20-21,23,25-29H,8,12-19H2,1-7H3/b10-9+/t21-,23-,25+,26+,27-,28+,29+,30+,31-/m1/s1 |
 |
| SMILES (mnx) | [CH3:1][CH2:8][C@H:23](/[CH:10]=[CH:9]/[C@@H:21]([CH3:4])[C@H:27]1[CH2:13][CH2:14][C@H:28]2[C@@H:26]3[CH2:12][CH:11]=[C:24]4[CH2:19][C@@H:25]([O:33][C:22]([CH3:5])=[O:32])[CH2:15][CH2:17][C@:30]4([CH3:6])[C@H:29]3[CH2:16][CH2:18][C@:31]12[CH3:7])[CH:20]([CH3:2])[CH3:3] |
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