Ketcher 01161711312D 1   1.00000     0.00000     0

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  1 23  1  0     0  0
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  2 24  1  0     0  0
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 21 22  1  0     0  0
M  END
> <ID>
CHEBI:132719

> <NAME>
bianfugenine

> <DEFINITION>
An isoquinoline alkaloid that is dibenzo[de,h]quinolin-7-one carrying four methoxy substituents at positions 4, 5, 6 and 9.

> <STAR>
3

> <SYNONYM>
Dauriporphine

> <IUPAC_NAME>
4,5,6,9-tetramethoxy-7H-dibenzo[de,h]quinolin-7-one

> <FORMULA>
C20H17NO5

> <MASS>
351.353

> <MONOISOTOPIC_MASS>
351.11067

> <CHARGE>
0

> <SMILES>
O(C1=C2C=3C(=NC=CC3C(OC)=C1OC)C4=C(C2=O)C=C(OC)C=C4)C

> <INCHI>
InChI=1S/C20H17NO5/c1-23-10-5-6-11-13(9-10)17(22)15-14-12(7-8-21-16(11)14)18(24-2)20(26-4)19(15)25-3/h5-9H,1-4H3

> <INCHIKEY>
OOWSNEKQIRVGCG-UHFFFAOYSA-N

> <CAS_REGISTRY_NUMBER>
88142-60-3

> <CHEMIDPLUS>
88142-60-3

> <KNAPSACK_ACCESSION>
C00025775

> <PUBMED_CITATION>
16964757; 23059629; 26992921; 8281582

$$$$