(13R)-edaxadiene

Properties Image MNX_ID MNXM6498 reference chebi:63178 formula C20H34O global charge 0 mol weight 290.491 InChIKey TXBORCBWDUAHAC-MFHCWRBVSA-N InChI InChI=1S/C20H34O/c1-7-19(5,21)13-14-20(6)15(2)10-11-16-17(20)9-8-12-18(16,3)4/h7,11,15,17,21H,1,8-10,12-14H2,2-6H3/t15-,17+,19-,20+/m0/s1 SMILES C=C[C@](C)(O)CC[C@@]1(C)[C@@H]2CCCC(C)(C)C2=CC[C@@H]1C MNX internals InChI (mnx) InChI=1/C20H34O/c1-7-19(5,21)13-14-20(6)15(2)10-11-16-17(20)9-8-12-18(16,3)4/h7,11,15,17,21H,1,8-10,12-14H2,2-6H3/t15-,17+,19-,20+/m0/s1 SMILES (mnx) [CH2:1]=[CH:7][C@@:19]([CH3:5])([CH2:13][CH2:14][C@:20]1([CH3:6])[C@@H:15]([CH3:2])[CH2:10][CH:11]=[C:16]2[C@H:17]1[CH2:9][CH2:8][CH2:12][C:18]2([CH3:3])[CH3:4])[OH:21]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 1 in models (compartimentalized) 1