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Asn-Tyr-Ser

PropertiesImage
MNX_IDMNXM1122830 Image of MNXM1122830
referencechebi:160226
formulaC16H22N4O7
global charge0
mol weight382.373
InChIKeyDPWDPEVGACCWTC-SRVKXCTJSA-N
InChIInChI=1S/C16H22N4O7/c17-10(6-13(18)23)14(24)19-11(5-8-1-3-9(22)4-2-8)15(25)20-12(7-21)16(26)27/h1-4,10-12,21-22H,5-7,17H2,(H2,18,23)(H,19,24)(H,20,25)(H,26,27)/t10-,11-,12-/m0/s1
SMILESNC(=O)C[C@H](N)C(=O)N[C@@H](CC1=CC=C(O)C=C1)C(=O)N[C@@H](CO)C(=O)O
MNX internals
InChI (mnx)InChI=1/C16H22N4O7/c17-10(6-13(18)23)14(24)19-11(5-8-1-3-9(22)4-2-8)15(25)20-12(7-21)16(26)27/h1-4,10-12,21-22H,5-7,17H2,(H2,18,23)(H,19,24)(H,20,25)(H,26,27)/t10-,11-,12-/m0/s1 Image of MNXM1122830
SMILES (mnx)[CH:1]1=[CH:3][C:9]([OH:22])=[CH:4][CH:2]=[C:8]1[CH2:5][C@@H:11]([C:15](=[N:20][C@@H:12]([CH2:7][OH:21])[C:16](=[O:26])[OH:27])[OH:25])[N:19]=[C:14]([C@H:10]([CH2:6][C:13](=[NH:18])[OH:23])[NH2:17])[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:160226
chebi:160226
DPWDPEVGACCWTC-SRVKXCTJSA-N
Asn-Tyr-Ser
(2S)-2-[[(2S)-2-[[(2S)-2,4-diamino-4-oxobutanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-hydroxypropanoic acid