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(Q104403212)
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English
(10R,11S,15R)-10-(7-methoxy-2H-1,3-benzodioxol-5-yl)-4,6,13-trioxatetracyclo[7.7.0.0³,⁷.0¹¹,¹⁵]hexadeca-1,3(7),8-trien-12-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
5-(7-Methoxy-2H-1,3-benzodioxol-5-yl)-5,8,8a,9-tetrahydro-2H-furo[3',4':6,7]naphtho[2,3-d][1,3]dioxol-6(5aH)-one
1 reference
based on heuristic
inferred from SMILES
10-(7-methoxy-2H-1,3-benzodioxol-5-yl)-4,6,13-trioxatetracyclo[7.7.0.0³,⁷.0¹¹,¹⁵]hexadeca-1,3(7),8-trien-12-one
1 reference
based on heuristic
inferred from SMILES
mass
382.1052529159999
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
stereoisomer of
Austrobailignan 1
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₂₁H₁₈O₇
0 references
canonical SMILES
O=C1OCC2CC3=CC=4OCOC4C=C3C(C5=CC(OC)=C6OCOC6=C5)C12
0 references
isomeric SMILES
COc1cc([C@@H]2c3cc4c(cc3C[C@H]3COC(=O)[C@H]32)OCO4)cc2c1OCO2
0 references
found in taxon
Austrobaileya scandens
1 reference
stated in
Some constituents of Austrobaileya scandens (Austrobaileyaceae) : structures of seven new lignans
Identifiers
InChI
InChI=1S/C21H18O7/c1-23-16-4-11(5-17-20(16)28-9-27-17)18-13-6-15-14(25-8-26-15)3-10(13)2-12-7-24-21(22)19(12)18/h3-6,12,18-19H,2,7-9H2,1H3/t12-,18+,19+/m0/s1
0 references
InChIKey
GROYKMASYUMFER-GESALYCCSA-N
0 references
PubChem CID
10339853
1 reference
based on heuristic
inferred from InChIKey
UniChem compound ID
487273
1 reference
stated in
UniChem
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