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Arg-Ala-Phe

PropertiesImage
MNX_IDMNXM1121319 Image of MNXM1121319
referencechebi:158707
formulaC18H28N6O4
global charge0
mol weight392.46
InChIKeySBVJJNJLFWSJOV-UBHSHLNASA-N
InChIInChI=1S/C18H28N6O4/c1-11(23-16(26)13(19)8-5-9-22-18(20)21)15(25)24-14(17(27)28)10-12-6-3-2-4-7-12/h2-4,6-7,11,13-14H,5,8-10,19H2,1H3,(H,23,26)(H,24,25)(H,27,28)(H4,20,21,22)/t11-,13-,14-/m0/s1
SMILESC[C@H](NC(=O)[C@@H](N)CCCN=C(N)N)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)O
MNX internals
InChI (mnx)InChI=1/C18H28N6O4/c1-11(23-16(26)13(19)8-5-9-22-18(20)21)15(25)24-14(17(27)28)10-12-6-3-2-4-7-12/h2-4,6-7,11,13-14H,5,8-10,19H2,1H3,(H,23,26)(H,24,25)(H,27,28)(H4,20,21,22)/t11-,13-,14-/m0/s1 Image of MNXM1121319
SMILES (mnx)[CH3:1][C@@H:11]([C:15](=[N:24][C@@H:14]([CH2:10][C:12]1=[CH:6][CH:3]=[CH:2][CH:4]=[CH:7]1)[C:17](=[O:27])[OH:28])[OH:25])[N:23]=[C:16]([C@H:13]([CH2:8][CH2:5][CH2:9][NH:22][C:18](=[NH:20])[NH2:21])[NH2:19])[OH:26]
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:158707
chebi:158707
SBVJJNJLFWSJOV-UBHSHLNASA-N
Arg-Ala-Phe
(2S)-2-[[(2S)-2-[[(2S)-2-amino-5-(diaminomethylideneamino)pentanoyl]amino]propanoyl]amino]-3-phenylpropanoic acid