compound 0068049

Properties Image MNX_ID MNXM1186195 reference envipathM:...4ac2429b3d2a formula C17H19NO5 global charge 0 mol weight 317.341 InChIKey HLAVBEQMNYTKAC-BNVHZMNASA-N InChI InChI=1S/C17H19NO5/c1-18-7-6-16-11-5-4-10(20)15(16)23-13-9(19)3-2-8(12(13)16)14(21)17(11,18)22/h2-3,11,14-15,19,21-22H,4-7H2,1H3/t11-,14?,15?,16+,17?/m1/s1 SMILES CN1CC[C@]23C4=C5OC2C(=O)CC[C@H]3C1(O)C(O)C4=CC=C5O MNX internals InChI (mnx) InChI=1/C17H19NO5/c1-18-7-6-16-11-5-4-10(20)15(16)23-13-9(19)3-2-8(12(13)16)14(21)17(11,18)22/h2-3,11,14-15,19,21-22H,4-7H2,1H3/t11-,14?,15?,16+,17?/m1/s1 SMILES (mnx) [CH3:1][N:18]1[CH2:7][CH2:6][C@@:16]23[C@H:11]4[CH2:5][CH2:4][C:10](=[O:20])[CH:15]2[O:23][C:13]2=[C:9]([OH:19])[CH:3]=[CH:2][C:8](=[C:12]23)[CH:14]([OH:21])[C:17]41[OH:22]

Parent-child relations graph

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