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AMD 070

PropertiesImage
MNX_IDMNXM102662 Image of MNXM102662
referencechebi:138865
formulaC21H27N5
global charge0
mol weight349.482
InChIKeyWVLHHLRVNDMIAR-IBGZPJMESA-N
InChIInChI=1S/C21H27N5/c22-12-3-4-14-26(15-20-24-17-9-1-2-10-18(17)25-20)19-11-5-7-16-8-6-13-23-21(16)19/h1-2,6,8-10,13,19H,3-5,7,11-12,14-15,22H2,(H,24,25)/t19-/m0/s1
SMILESNCCCCN(CC1=NC2=C(C=CC=C2)N1)[C@H]1CCCC2=C1N=CC=C2
MNX internals
InChI (mnx)InChI=1/C21H27N5/c22-12-3-4-14-26(15-20-24-17-9-1-2-10-18(17)25-20)19-11-5-7-16-8-6-13-23-21(16)19/h1-2,6,8-10,13,19H,3-5,7,11-12,14-15,22H2,(H,24,25)/t19-/m0/s1 Image of MNXM102662
SMILES (mnx)[CH:1]1=[CH:2][CH:10]=[C:18]2[C:17](=[CH:9]1)[N:24]=[C:20]([CH2:15][N:26]([CH2:14][CH2:4][CH2:3][CH2:12][NH2:22])[C@H:19]1[CH2:11][CH2:5][CH2:7][C:16]3=[C:21]1[N:23]=[CH:13][CH:6]=[CH:8]3)[NH:25]2
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)0
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

seed.compound:cpd21496
seedM:cpd21496
CHEBI:138865
chebi:138865
kegg.compound:C20266
keggC:C20266
WVLHHLRVNDMIAR-IBGZPJMESA-N
WVLHHLRVNDMIAR-IBGZPJMESA-P 		AMD 070
hmdb:HMDB0246964
WVLHHLRVNDMIAR-UHFFFAOYSA-N 		(S)-N1-((1H-Benzo[d]imidazol-2-yl)methyl)-N1-(5,6,7,8-tetrahydroquinolin-8-yl)butane-1,4-diamine
N-(4-aminobutyl)-N-(1H-1,3-benzodiazol-2-ylmethyl)-5,6,7,8-tetrahydroquinolin-8-amine
N-(4-aminobutyl)-N-[(1H-1,3-benzodiazol-2-yl)methyl]-5,6,7,8-tetrahydroquinolin-8-amine

kegg.drug:D11510
keggD:D11510
WVLHHLRVNDMIAR-IBGZPJMESA-N 		Mavorixafor (USAN)
Xolremdi (TN)

keggC:M_C20266
keggD:M_D11510
seedM:M_cpd21496 		secondary/obsolete/fantasy identifier