(Q105186417)

English

5-[(1R)-5-hydroxy-7-methoxy-3-oxo-1H-2-benzofuran-1-yl]-2-[(E)-prop-1-enyl]-1H-pyridin-4-one

chemical compound

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Statements

instance of

type of chemical entity

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subclass of

5-(5-hydroxy-7-methoxy-3-oxo-1H-2-benzofuran-1-yl)-2-prop-1-enyl-1H-pyridin-4-one

1 reference

based on heuristic

inferred from SMILES

mass

313.09502258 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₁₇H₁₅NO₅

0 references

canonical SMILES

O=C1OC(C2=CNC(C=CC)=CC2=O)C=3C(OC)=CC(O)=CC13

0 references

isomeric SMILES

C/C=C/c1cc(=O)c([C@@H]2OC(=O)c3cc(O)cc(OC)c32)c[nH]1

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found in taxon

Penicillium

2 references

stated in

Penicidones A-C, three cytotoxic alkaloidal metabolites of an endophytic Penicillium sp.

stated in

Penicidones A-C, three cytotoxic alkaloidal metabolites of an endophytic Penicillium sp.

Identifiers

InChI

InChI=1S/C17H15NO5/c1-3-4-9-5-13(20)12(8-18-9)16-15-11(17(21)23-16)6-10(19)7-14(15)22-2/h3-8,16,19H,1-2H3,(H,18,20)/b4-3+/t16-/m0/s1

0 references

InChIKey

NVUHVZUPJHEJGT-CWDCEQMOSA-N

0 references

2 references

26 December 2021

matched by identifier from

InChIKey

NVUHVZUPJHEJGT-CWDCEQMOSA-N

ChEBI ID

209556

mapping relation type

exact match

1 reference

matched by identifier from

International Chemical Identifier

InChI

InChI=1S/C17H15NO5/c1-3-4-9-5-13(20)12(8-18-9)16-15-11(17(21)23-16)6-10(19)7-14(15)22-2/h3-8,16,19H,1-2H3,(H,18,20)/b4-3+/t16-/m0/s1

1 reference

Natural Product Atlas ID

NPA018391

2 references

based on heuristic

inferred from InChIKey

matched by identifier from

InChIKey

NVUHVZUPJHEJGT-CWDCEQMOSA-N

(Q105186417)

5-[(1R)-5-hydroxy-7-methoxy-3-oxo-1H-2-benzofuran-1-yl]-2-[(E)-prop-1-enyl]-1H-pyridin-4-one

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