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4 Hydroxymethyl-gepirone

Properties Image MNX_ID MNXM1594611 reference vmhM:geprn4oh vmhM:geprn4oh formula C19H30N5O3 global charge 1 mol weight 376.481 InChIKey CZKLWRLTNBOHFU-UHFFFAOYSA-O InChI InChI=1S/C19H29N5O3/c1-19(15-25)13-16(26)24(17(27)14-19)8-3-2-7-22-9-11-23(12-10-22)18-20-5-4-6-21-18/h4-6,25H,2-3,7-15H2,1H3/p+1 SMILES CC1(CO)CC(=O)N(CCCC[NH+]2CCN(c3ncccn3)CC2)C(=O)C1 MNX internals InChI (mnx) InChI=1/C19H29N5O3/c1-19(15-25)13-16(26)24(17(27)14-19)8-3-2-7-22-9-11-23(12-10-22)18-20-5-4-6-21-18/h4-6,25H,2-3,7-15H2,1H3 SMILES (mnx) [CH3:1][C:19]1([CH2:15][OH:25])[CH2:13][C:16](=[O:26])[N:24]([CH2:8][CH2:3][CH2:2][CH2:7][N:22]2[CH2:9][CH2:11][N:23]([c:18]3[n:20][cH:5][cH:4][cH:6][n:21]3)[CH2:12][CH2:10]2)[C:17](=[O:27])[CH2:14]1

Parent-child relations graph

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

Similar chemical compounds in external resources

Identifier	Description
vmhM:geprn4oh vmhM:geprn4oh vmhmetabolite:geprn4oh vmhmetabolite:geprn4oh CZKLWRLTNBOHFU-UHFFFAOYSA-O	4 Hydroxymethyl-gepirone
vmhM:M_geprn4oh	secondary/obsolete/fantasy identifier