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Mycosporine-GABA
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
4-[[5-Hydroxy-5-(hydroxymethyl)-2-methoxy-3-oxocyclohexen-1-yl]amino]butanoic acid
1 reference
based on heuristic
inferred from SMILES
mass
273.121237328
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₂H₁₉NO₆
0 references
canonical SMILES
O=C(O)CCCNC1=C(OC)C(=O)CC(O)(CO)C1
0 references
isomeric SMILES
COC1=C(NCCCC(=O)O)C[C@@](O)(CO)CC1=O
0 references
found in taxon
Nostoc commune
1 reference
stated in
Characterization of the chemical diversity of glycosylated mycosporine-like amino acids in the terrestrial cyanobacterium Nostoc commune.
Identifiers
InChI
InChI=1S/C12H19NO6/c1-19-11-8(13-4-2-3-10(16)17)5-12(18,7-14)6-9(11)15/h13-14,18H,2-7H2,1H3,(H,16,17)/t12-/m0/s1
0 references
InChIKey
PHMFQSVGWKFYII-LBPRGKRZSA-N
0 references
PubChem CID
155802263
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
PHMFQSVGWKFYII-LBPRGKRZSA-N
UniChem compound ID
187214220
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID001047495
1 reference
matched by identifier from
InChIKey
InChIKey
PHMFQSVGWKFYII-LBPRGKRZSA-N
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