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

(11R)-carlactonoate

Properties Image MNX_ID MNXM1378836 reference chebi:194504 formula C19H23O5 global charge -1 mol weight 331.388 InChIKey WUBRWXCVIPHXLX-XMAHBSJYSA-M InChI InChI=1S/C19H24O5/c1-12-6-5-9-19(3,4)15(12)8-7-14(17(20)21)11-23-16-10-13(2)18(22)24-16/h7-8,10-11,16H,5-6,9H2,1-4H3,(H,20,21)/p-1/b8-7+,14-11+/t16-/m1/s1 SMILES CC1=C[C@H](O/C=C(\C=C\C2=C(C)CCCC2(C)C)C(=O)[O-])OC1=O MNX internals InChI (mnx) InChI=1/C19H24O5/c1-12-6-5-9-19(3,4)15(12)8-7-14(17(20)21)11-23-16-10-13(2)18(22)24-16/h7-8,10-11,16H,5-6,9H2,1-4H3,(H,20,21)/b8-7+,14-11+/t16-/m1/s1 SMILES (mnx) [CH3:1][C:12]1=[C:15](/[CH:8]=[CH:7]/[C:14](=[CH:11]\[O:23][C@H:16]2[CH:10]=[C:13]([CH3:2])[C:18](=[O:22])[O:24]2)[C:17]([OH:20])=[O:21])[C:19]([CH3:3])([CH3:4])[CH2:9][CH2:5][CH2:6]1

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 4 in models (compartimentalized) 2

Similar chemical compounds in external resources

Identifier	Description
CHEBI:194504 chebi:194504 WUBRWXCVIPHXLX-XMAHBSJYSA-M	(11R)-carlactonoate
kegg.compound:C23076 keggC:C23076 WUBRWXCVIPHXLX-XMAHBSJYSA-N	(11R)-Carlactonoic acid (11R)-Carlactonoate
keggC:M_C23076	secondary/obsolete/fantasy identifier