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(Q104666963)
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Cathafiline
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
aporphine alkaloids
0 references
mass
369.121237328
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₁₉NO₆
0 references
canonical SMILES
O=C(OC)N1CCC2=CC=3OCOC3C=4C5=CC(OC)=C(O)C=C5CC1C42
0 references
isomeric SMILES
COC(=O)N1CCc2cc3c(c4c2[C@@H]1Cc1cc(O)c(OC)cc1-4)OCO3
0 references
found in taxon
Cassytha filiformis
2 references
stated in
Antiplatelet and vasorelaxing actions of aporphinoids from Cassytha filiformis
stated in
Alkaloids from Cassytha filiformis
Identifiers
InChI
InChI=1S/C20H19NO6/c1-24-15-8-12-11(6-14(15)22)5-13-17-10(3-4-21(13)20(23)25-2)7-16-19(18(12)17)27-9-26-16/h6-8,13,22H,3-5,9H2,1-2H3/t13-/m0/s1
0 references
InChIKey
HOHBOJJFTZZXDF-ZDUSSCGKSA-N
0 references
PubChem CID
44575456
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
HOHBOJJFTZZXDF-ZDUSSCGKSA-N
UniChem compound ID
550616
1 reference
stated in
UniChem
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