| Properties | Image |
|---|
| MNX_ID | MNXM107747 |
 |
| reference | chebi:67847 |
| formula | C23H30O4 |
| global charge | 0 |
| mol weight | 370.489 |
| InChIKey | JDDYDTDIIFQNAG-WKZKVMAPSA-N |
| InChI | InChI=1S/C23H30O4/c1-13-10-16(25)14-11-18-22(4)8-7-19(26)21(2,3)17(22)6-9-23(18,5)27-20(14)15(13)12-24/h10,12,17-18,25H,6-9,11H2,1-5H3/t17-,18+,22-,23-/m0/s1 |
| SMILES | CC1=C(C=O)C2=C(C[C@@H]3[C@@]4(C)CCC(=O)C(C)(C)[C@@H]4CC[C@]3(C)O2)C(O)=C1 |
MNX internals
| InChI (mnx) | InChI=1/C23H30O4/c1-13-10-16(25)14-11-18-22(4)8-7-19(26)21(2,3)17(22)6-9-23(18,5)27-20(14)15(13)12-24/h10,12,17-18,25H,6-9,11H2,1-5H3/t17-,18+,22-,23-/m0/s1 |
 |
| SMILES (mnx) | [CH3:1][C:13]1=[C:15]([CH:12]=[O:24])[C:20]2=[C:14]([CH2:11][C@@H:18]3[C@@:22]4([CH3:4])[CH2:8][CH2:7][C:19](=[O:26])[C:21]([CH3:2])([CH3:3])[C@@H:17]4[CH2:6][CH2:9][C@:23]3([CH3:5])[O:27]2)[C:16]([OH:25])=[CH:10]1 |
|