dihydroxyphenyl-5-methyloxazoline-norspermidine-2,3-dihydroxybenzoate

Properties Image MNX_ID MNXM11390 reference metacycM:CPD-11952 formula C24H30N4O7 global charge 0 mol weight 486.525 InChIKey FNJFOXJURHYRMA-QMRFKDRMSA-N InChI InChI=1S/C24H30N4O7/c1-14-20(28-24(35-14)15-7-8-17(29)19(31)13-15)23(34)27-12-4-10-25-9-3-11-26-22(33)16-5-2-6-18(30)21(16)32/h2,5-8,13-14,20,25,29-32H,3-4,9-12H2,1H3,(H,26,33)(H,27,34)/t14-,20?/m1/s1 SMILES C[C@H]1OC(C2=CC=C(O)C(O)=C2)=NC1C(=O)NCCCNCCCNC(=O)C1=C(O)C(O)=CC=C1 MNX internals InChI (mnx) InChI=1/C24H30N4O7/c1-14-20(28-24(35-14)15-7-8-17(29)19(31)13-15)23(34)27-12-4-10-25-9-3-11-26-22(33)16-5-2-6-18(30)21(16)32/h2,5-8,13-14,20,25,29-32H,3-4,9-12H2,1H3,(H,26,33)(H,27,34)/t14-,20?/m1/s1 SMILES (mnx) [CH3:1][C@@H:14]1[CH:20]([C:23](=[N:27][CH2:12][CH2:4][CH2:10][NH:25][CH2:9][CH2:3][CH2:11][N:26]=[C:22]([C:16]2=[C:21]([OH:32])[C:18]([OH:30])=[CH:6][CH:2]=[CH:5]2)[OH:33])[OH:34])[N:28]=[C:24]([C:15]2=[CH:13][C:19]([OH:31])=[C:17]([OH:29])[CH:8]=[CH:7]2)[O:35]1

Parent-child relations graph

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