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CHEBI:40866 - N-(3-AMINO-2-HYDROXY-5-METHYLHEXANOYL)VALYLVALYLASPARTIC ACID

Default Structure
ChEBI IDCHEBI:40866
ChEBI NameN-(3-AMINO-2-HYDROXY-5-METHYLHEXANOYL)VALYLVALYLASPARTIC ACID
Stars
Last Modified16 May 2008
DownloadsMolfile
FormulaC21H38N4O8
Net Charge0
Average Mass474.555
Monoisotopic Mass474.26896
SMILES[H]OC(=O)C([H])([H])[C@@]([H])(C(=O)O[H])N([H])C(=O)[C@]([H])(N([H])C(=O)[C@@]([H])(N([H])C(=O)[C@@]([H])(O[H])[C@]([H])(N([H])[H])C([H])([H])C([H])(C([H])([H])[H])C([H])([H])[H])C([H])(C([H])([H])[H])C([H])([H])[H])C([H])(C([H])([H])[H])C([H])([H])[H]
InChIInChI=1S/C21H38N4O8/c1-9(2)7-12(22)17(28)20(31)25-16(11(5)6)19(30)24-15(10(3)4)18(29)23-13(21(32)33)8-14(26)27/h9-13,15-17,28H,7-8,22H2,1-6H3,(H,23,29)(H,24,30)(H,25,31)(H,26,27)(H,32,33)/t12-,13+,15-,16+,17+/m1/s1
InChIKeyQFAADIRHLBXJJS-FITYOTRXSA-N
ChEBI Ontology
Outgoing Relation(s)
N-(3-AMINO-2-HYDROXY-5-METHYLHEXANOYL)VALYLVALYLASPARTIC ACID (CHEBI:40866) is a unclassifieds (CHEBI:27189)
Synonyms  Source
N-[(2S,3R)-3-amino-2-hydroxy-5-methylhexanoyl]-L-valyl-D-valyl-L-aspartic acidPDBeChem
N-(3-AMINO-2-HYDROXY-5-METHYLHEXANOYL)VALYLVALYLASPARTIC ACIDPDBeChem
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