| Properties | Image |
|---|
| MNX_ID | MNXM107095 |
 |
| reference | chebi:67715 |
| formula | C22H33NO2 |
| global charge | 0 |
| mol weight | 343.511 |
| InChIKey | RSFPISDAJMWREU-UACFYWDWSA-N |
| InChI | InChI=1S/C22H33NO2/c1-13-17-6-7-19-16-5-4-14-12-15(23-3)8-10-21(14,2)18(16)9-11-22(17,19)20(24)25-13/h4,13,15-19,23H,5-12H2,1-3H3/t13-,15+,16+,17+,18-,19-,21-,22-/m0/s1 |
| SMILES | CN[C@@H]1CC[C@@]2(C)C(=CC[C@H]3[C@@H]4CC[C@@H]5[C@H](C)OC(=O)[C@@]54CC[C@@H]32)C1 |
MNX internals
| InChI (mnx) | InChI=1/C22H33NO2/c1-13-17-6-7-19-16-5-4-14-12-15(23-3)8-10-21(14,2)18(16)9-11-22(17,19)20(24)25-13/h4,13,15-19,23H,5-12H2,1-3H3/t13-,15+,16+,17+,18-,19-,21-,22-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][C@H:13]1[C@H:17]2[CH2:6][CH2:7][C@H:19]3[C@@H:16]4[CH2:5][CH:4]=[C:14]5[CH2:12][C@H:15]([NH:23][CH3:3])[CH2:8][CH2:10][C@:21]5([CH3:2])[C@H:18]4[CH2:9][CH2:11][C@:22]23[C:20](=[O:24])[O:25]1 |
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