ent-14beta-hydroxy-18-acetoxykaur-16-ene

Properties Image MNX_ID MNXM104847 reference chebi:69104 formula C22H34O3 global charge 0 mol weight 346.511 InChIKey QLKIDMAQBRGVKC-FFFWSKEGSA-N InChI InChI=1S/C22H34O3/c1-14-12-22-11-8-17-20(3,13-25-15(2)23)9-5-10-21(17,4)18(22)7-6-16(14)19(22)24/h16-19,24H,1,5-13H2,2-4H3/t16-,17-,18+,19-,20-,21-,22+/m1/s1 SMILES C=C1C[C@@]23CC[C@@H]4[C@@](C)(COC(C)=O)CCC[C@@]4(C)[C@@H]2CC[C@H]1[C@H]3O MNX internals InChI (mnx) InChI=1/C22H34O3/c1-14-12-22-11-8-17-20(3,13-25-15(2)23)9-5-10-21(17,4)18(22)7-6-16(14)19(22)24/h16-19,24H,1,5-13H2,2-4H3/t16-,17-,18+,19-,20-,21-,22+/m1/s1 SMILES (mnx) [CH2:1]=[C:14]1[CH2:12][C@@:22]23[CH2:11][CH2:8][C@@H:17]4[C@@:20]([CH3:3])([CH2:13][O:25][C:15]([CH3:2])=[O:23])[CH2:9][CH2:5][CH2:10][C@@:21]4([CH3:4])[C@@H:18]2[CH2:7][CH2:6][C@H:16]1[C@H:19]3[OH:24]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 0 in models (compartimentalized) 0