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(Q104401729)
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O-Demethylrenierone
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
isoquinoline alkaloid
0 references
mass
301.09502258
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₆H₁₅NO₅
0 references
canonical SMILES
O=C(OCC1=NC=CC=2C(O)=C(C(=O)C(=O)C21)C)C(=CC)C
0 references
isomeric SMILES
C/C=C(/C)C(=O)OCc1nccc2c1C(=O)C(=O)C(C)=C2O
1 reference
based on heuristic
inferred from InChI
found in taxon
Cribrochalina
1 reference
stated in
Isolation and structure of cribrostatins 1 and 2 from the blue marine sponge Cribrochalinasp
Reniera
1 reference
stated in
Antimicrobial metabolites of the sponge Reniera sp
Reniera
1 reference
stated in
Antimicrobial metabolites of the sponge Reniera sp
Identifiers
InChI
InChI=1S/C16H15NO5/c1-4-8(2)16(21)22-7-11-12-10(5-6-17-11)13(18)9(3)14(19)15(12)20/h4-6,18H,7H2,1-3H3/b8-4-
0 references
InChIKey
UHGGVLIEIYEISB-YWEYNIOJSA-N
0 references
PubChem CID
23424592
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
UHGGVLIEIYEISB-YWEYNIOJSA-N
UniChem compound ID
52543980
1 reference
stated in
UniChem
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