3,4-seco-sonderianol

Properties Image MNX_ID MNXM101774 reference chebi:69176 formula C21H28O3 global charge 0 mol weight 328.452 InChIKey CXOXYGZFBDGZJN-DYESRHJHSA-N InChI InChI=1S/C21H28O3/c1-7-15-14(4)19(22)12-18-16(15)8-9-17(13(2)3)21(18,5)11-10-20(23)24-6/h7,12,17,22H,1-2,8-11H2,3-6H3/t17-,21-/m1/s1 SMILES C=CC1=C(C)C(O)=CC2=C1CC[C@H](C(=C)C)[C@@]2(C)CCC(=O)OC MNX internals InChI (mnx) InChI=1/C21H28O3/c1-7-15-14(4)19(22)12-18-16(15)8-9-17(13(2)3)21(18,5)11-10-20(23)24-6/h7,12,17,22H,1-2,8-11H2,3-6H3/t17-,21-/m1/s1 SMILES (mnx) [CH2:1]=[CH:7][C:15]1=[C:16]2[CH2:8][CH2:9][C@H:17]([C:13](=[CH2:2])[CH3:3])[C@@:21]([CH3:5])([CH2:11][CH2:10][C:20](=[O:23])[O:24][CH3:6])[C:18]2=[CH:12][C:19]([OH:22])=[C:14]1[CH3:4]

Parent-child relations graph

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