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InChI=1S/CH4O/c1-2/h2H,1H3
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ChEBI
> Main
CHEBI:2645 - Amino acid(Tyr-, Trp-, Phe-, Leu-)
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ChEBI Name
Amino acid(Tyr-, Trp-, Phe-, Leu-)
ChEBI ID
CHEBI:2645
Stars
This entity has been manually annotated by a third party.
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Formula
C11H12N2O2.C9H11NO3.C9H11NO2.C6H13NO2
Net Charge
0
Average Mass
681.787
Monoisotopic Mass
681.33738
InChI
InChI=1S/C11H12N2O2.C9H11NO3.C9H11NO2.C6H13NO2/c12-
9(11(14)
15)
5-
7-
6-
13-
10-
4-
2-
1-
3-
8(7)
10;10-
8(9(12)
13)
5-
6-
1-
3-
7(11)
4-
2-
6;10-
8(9(11)
12)
6-
7-
4-
2-
1-
3-
5-
7;1-
4(2)
3-
5(7)
6(8)
9/h1-
4,6,9,13H,5,12H2,(H,14,15)
;1-
4,8,11H,5,10H2,(H,12,13)
;1-
5,8H,6,10H2,(H,11,12)
;4-
5H,3,7H2,1-
2H3,(H,8,9)
InChIKey
OCPCGTMWPUCGIE-UHFFFAOYSA-N
SMILES
CC(C)CC(N)C(O)=O.NC(Cc1ccccc1)C(O)=O.NC(Cc1ccc(O)cc1)C(O)=O.NC(Cc1c[nH]c2ccccc12)C(O)=O
ChEBI Ontology
Outgoing
Amino acid(Tyr-, Trp-, Phe-, Leu-) (
CHEBI:2645
)
is a
organic molecular entity (
CHEBI:50860
)
Synonym
Source
Amino acid(Tyr-, Trp-, Phe-, Leu-)
KEGG COMPOUND
Manual Xref
Database
C04245
KEGG COMPOUND
View more database links
Last Modified
28 July 2014