13-hydroxylupanine

Properties Image MNX_ID MNXM1371287 reference metacycM:13-HYDROXYLUPININE formula C15H25N2O2 global charge 1 mol weight 265.377 InChIKey JVYKIBAJVKEZSQ-XHLRWWMNSA-O InChI InChI=1S/C15H24N2O2/c18-12-4-5-16-8-10-6-11(14(16)7-12)9-17-13(10)2-1-3-15(17)19/h10-14,18H,1-9H2/p+1/t10?,11?,12-,13?,14?/m1/s1 SMILES O=C1CCCC2C3CC(CN12)C1C[C@H](O)CC[NH+]1C3 MNX internals InChI (mnx) InChI=1/C15H24N2O2/c18-12-4-5-16-8-10-6-11(14(16)7-12)9-17-13(10)2-1-3-15(17)19/h10-14,18H,1-9H2/t10?,11?,12-,13?,14?/m1/s1 SMILES (mnx) [CH2:1]1[CH2:2][CH:13]2[CH:10]3[CH2:6][CH:11]([CH2:9][N:17]2[C:15](=[O:19])[CH2:3]1)[CH:14]1[CH2:7][C@H:12]([OH:18])[CH2:4][CH2:5][N:16]1[CH2:8]3

Parent-child relations graph

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