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His-Leu-Leu

PropertiesImage
MNX_IDMNXM1127190 Image of MNXM1127190
referencechebi:164609
formulaC18H31N5O4
global charge0
mol weight381.477
InChIKeyYAALVYQFVJNXIV-KKUMJFAQSA-N
InChIInChI=1S/C18H31N5O4/c1-10(2)5-14(17(25)23-15(18(26)27)6-11(3)4)22-16(24)13(19)7-12-8-20-9-21-12/h8-11,13-15H,5-7,19H2,1-4H3,(H,20,21)(H,22,24)(H,23,25)(H,26,27)/t13-,14-,15-/m0/s1
SMILESCC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC1=CN=CN1)C(=O)O
MNX internals
InChI (mnx)InChI=1/C18H31N5O4/c1-10(2)5-14(17(25)23-15(18(26)27)6-11(3)4)22-16(24)13(19)7-12-8-20-9-21-12/h8-11,13-15H,5-7,19H2,1-4H3,(H,20,21)(H,22,24)(H,23,25)(H,26,27)/t13-,14-,15-/m0/s1 Image of MNXM1127190
SMILES (mnx)[CH3:1][CH:10]([CH3:2])[CH2:5][C@@H:14]([C:17](=[N:23][C@@H:15]([CH2:6][CH:11]([CH3:3])[CH3:4])[C:18](=[O:26])[OH:27])[OH:25])[N:22]=[C:16]([C@H:13]([CH2:7][C:12]1=[CH:8][N:20]=[CH:9][NH:21]1)[NH2:19])[OH:24]
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

CHEBI:164609
chebi:164609
YAALVYQFVJNXIV-KKUMJFAQSA-N
His-Leu-Leu
(2S)-2-[[(2S)-2-[[(2S)-2-amino-3-(1H-imidazol-5-yl)propanoyl]amino]-4-methylpentanoyl]amino]-4-methylpentanoic acid