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(Q104981956)
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English
12balpha-Hydroxy-5,6-dihydro-9,10-dimethoxy-8H-1,3-dioxolo[4,5-h]isoindolo[1,2-b][3]benzazepine-8,13(12bH)-dione
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
Chilenine
1 reference
based on heuristic
inferred from SMILES
mass
383.100501884
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
12bbeta-Hydroxy-5,6-dihydro-9,10-dimethoxy-8H-1,3-dioxolo[4,5-h]isoindolo[1,2-b][3]benzazepine-8,13(12bH)-dione
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₁₇NO₇
0 references
canonical SMILES
O=C1C2=C(OC)C(OC)=CC=C2C3(O)C(=O)C4=CC=5OCOC5C=C4CCN13
0 references
isomeric SMILES
COc1ccc2c(c1OC)C(=O)N1CCc3cc4c(cc3C(=O)[C@]21O)OCO4
0 references
found in taxon
Berberis vulgaris
1 reference
stated in
Isoquinoline alkaloids from Berberis Vulgaris subsp. Australis
Identifiers
InChI
InChI=1S/C20H17NO7/c1-25-13-4-3-12-16(17(13)26-2)19(23)21-6-5-10-7-14-15(28-9-27-14)8-11(10)18(22)20(12,21)24/h3-4,7-8,24H,5-6,9H2,1-2H3/t20-/m1/s1
0 references
InChIKey
DJCOYPJXFKNBCF-HXUWFJFHSA-N
0 references
PubChem CID
25764129
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
DJCOYPJXFKNBCF-HXUWFJFHSA-N
UniChem compound ID
7266846
1 reference
stated in
UniChem
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