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Thr-Ile-Asn

PropertiesImage
MNX_IDMNXM1126557 Image of MNXM1126557
referencechebi:163972
formulaC14H26N4O6
global charge0
mol weight346.384
InChIKeyPAXANSWUSVPFNK-IUKAMOBKSA-N
InChIInChI=1S/C14H26N4O6/c1-4-6(2)11(18-12(21)10(16)7(3)19)13(22)17-8(14(23)24)5-9(15)20/h6-8,10-11,19H,4-5,16H2,1-3H3,(H2,15,20)(H,17,22)(H,18,21)(H,23,24)/t6-,7+,8-,10-,11-/m0/s1
SMILESCC[C@H](C)[C@H](NC(=O)[C@@H](N)[C@@H](C)O)C(=O)N[C@@H](CC(N)=O)C(=O)O
MNX internals
InChI (mnx)InChI=1/C14H26N4O6/c1-4-6(2)11(18-12(21)10(16)7(3)19)13(22)17-8(14(23)24)5-9(15)20/h6-8,10-11,19H,4-5,16H2,1-3H3,(H2,15,20)(H,17,22)(H,18,21)(H,23,24)/t6-,7+,8-,10-,11-/m0/s1 Image of MNXM1126557
SMILES (mnx)[CH3:1][CH2:4][C@H:6]([CH3:2])[C@@H:11]([C:13](=[N:17][C@@H:8]([CH2:5][C:9](=[NH:15])[OH:20])[C:14](=[O:23])[OH:24])[OH:22])[N:18]=[C:12]([C@H:10]([C@@H:7]([CH3:3])[OH:19])[NH2:16])[OH:21]
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:163972
chebi:163972
PAXANSWUSVPFNK-IUKAMOBKSA-N
Thr-Ile-Asn
(2S)-4-amino-2-[[(2S,3S)-2-[[(2S,3R)-2-amino-3-hydroxybutanoyl]amino]-3-methylpentanoyl]amino]-4-oxobutanoic acid