**This is a beta version of MetaNetX/MNXref, MNXref identifiers may not be final**

avermitilol

Properties Image MNX_ID MNXM5630 reference chebi:63702 formula C15H26O global charge 0 mol weight 222.372 InChIKey BLGPPSRDEKNCLT-CDWXYHGHSA-N InChI InChI=1S/C15H26O/c1-9-5-6-11(16)15(4)8-7-10-13(12(9)15)14(10,2)3/h9-13,16H,5-8H2,1-4H3/t9-,10-,11+,12+,13-,15-/m1/s1 SMILES C[C@@H]1CC[C@H](O)[C@@]2(C)CC[C@@H]3[C@H]([C@H]12)C3(C)C MNX internals InChI (mnx) InChI=1/C15H26O/c1-9-5-6-11(16)15(4)8-7-10-13(12(9)15)14(10,2)3/h9-13,16H,5-8H2,1-4H3/t9-,10-,11+,12+,13-,15-/m1/s1 SMILES (mnx) [C@:1]12([CH3:11])[C@@H:2]([C@@H:4]([OH:16])[CH2:6][CH2:5][C@@H:3]1[CH3:15])[C@@H:10]1[C@H:8]([CH2:7][CH2:9]2)[C:12]1([CH3:13])[CH3:14]

Parent-child relations graph

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

Similar chemical compounds in external resources

Identifier	Description
CHEBI:63702 chebi:63702 BLGPPSRDEKNCLT-CDWXYHGHSA-N	avermitilol (1aR,3aS,4S,7R,7aS,7bR)-1,1,3a,7-tetramethyldecahydro-1H-cyclopropa[a]naphthalen-4-ol
kegg.compound:C20181 keggC:C20181 BLGPPSRDEKNCLT-CDWXYHGHSA-N	Avermitilol
seed.compound:cpd21414 seedM:cpd21414 BLGPPSRDEKNCLT-CDWXYHGHSA-N	Avermitilol avermitilol
metacyc.compound:CPD-13863 metacycM:CPD-13863 BLGPPSRDEKNCLT-CDWXYHGHSA-N	avermitilol
keggC:M_C20181 seedM:M_cpd21414	secondary/obsolete/fantasy identifier