**This is a beta version of MetaNetX/MNXref, MNXref identifiers may not be final**

3',5-di-Hydroxy Gepirone

Properties Image MNX_ID MNXM1594609 reference vmhM:geprn35doh vmhM:geprn35doh formula C19H30N5O4 global charge 1 mol weight 392.48 InChIKey QQMVSPAEOUEOLJ-UHFFFAOYSA-O InChI InChI=1S/C19H29N5O4/c1-19(2)11-15(26)24(17(28)16(19)27)6-4-3-5-22-7-9-23(10-8-22)18-20-12-14(25)13-21-18/h12-13,16,25,27H,3-11H2,1-2H3/p+1 SMILES CC1(C)CC(=O)N(CCCC[NH+]2CCN(c3ncc(O)cn3)CC2)C(=O)C1O MNX internals InChI (mnx) InChI=1/C19H29N5O4/c1-19(2)11-15(26)24(17(28)16(19)27)6-4-3-5-22-7-9-23(10-8-22)18-20-12-14(25)13-21-18/h12-13,16,25,27H,3-11H2,1-2H3/t16? SMILES (mnx) [CH3:1][C:19]1([CH3:2])[CH2:11][C:15](=[O:26])[N:24]([CH2:6][CH2:4][CH2:3][CH2:5][N:22]2[CH2:7][CH2:9][N:23]([c:18]3[n:20][cH:12][c:14]([OH:25])[cH:13][n:21]3)[CH2:10][CH2:8]2)[C:17](=[O:28])[CH:16]1[OH:27]

Parent-child relations graph

Occurences in reactions #reac in my sandbox 0 in MNXref (generic) 3 in models (compartimentalized) 0

Similar chemical compounds in external resources

Identifier	Description
vmhM:geprn35doh vmhM:geprn35doh vmhmetabolite:geprn35doh vmhmetabolite:geprn35doh QQMVSPAEOUEOLJ-UHFFFAOYSA-O	3',5-di-Hydroxy Gepirone
vmhM:M_geprn35doh	secondary/obsolete/fantasy identifier