Cepharatine A, (rel)-

Properties Image MNX_ID MNXM103639 reference chebi:68399 formula C18H19NO4 global charge 0 mol weight 313.353 InChIKey KDYWOWVAVXEYRU-MSOLQXFVSA-N InChI InChI=1S/C18H19NO4/c1-19-8-7-17-10-18(19,22)14(20)9-12(17)5-3-11-4-6-13(23-2)16(21)15(11)17/h3-6,9,21-22H,7-8,10H2,1-2H3/t17-,18+/m1/s1 SMILES COC1=C(O)C2=C(C=CC3=CC(=O)[C@@]4(O)C[C@]32CCN4C)C=C1 MNX internals InChI (mnx) InChI=1/C18H19NO4/c1-19-8-7-17-10-18(19,22)14(20)9-12(17)5-3-11-4-6-13(23-2)16(21)15(11)17/h3-6,9,21-22H,7-8,10H2,1-2H3/t17-,18+/m1/s1 SMILES (mnx) [CH3:1][N:19]1[CH2:8][CH2:7][C@@:17]23[CH2:10][C@:18]1([OH:22])[C:14](=[O:20])[CH:9]=[C:12]2[CH:5]=[CH:3][C:11]1=[CH:4][CH:6]=[C:13]([O:23][CH3:2])[C:16]([OH:21])=[C:15]13

Parent-child relations graph

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