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(Q105384063)
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English
10,7'-O,O-Didemethylcephaeline
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
isoquinoline alkaloid
0 references
mass
438.251857568
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₆H₃₄N₂O₄
0 references
canonical SMILES
OC=1C=C2C(=CC1O)C(NCC2)CC3CC4C5=CC(O)=C(OC)C=C5CCN4CC3CC
0 references
isomeric SMILES
CC[C@H]1CN2CCc3cc(OC)c(O)cc3[C@@H]2C[C@@H]1C[C@H]1NCCc2cc(O)c(O)cc21
0 references
found in taxon
Alangium lamarckii
1 reference
stated in
Two Alangium alkaloids from Alangium lamarckii
Alangium salviifolium
1 reference
stated in
Two Alangium alkaloids from Alangium lamarckii
Identifiers
InChI
InChI=1S/C26H34N2O4/c1-3-15-14-28-7-5-17-11-26(32-2)25(31)13-20(17)22(28)9-18(15)8-21-19-12-24(30)23(29)10-16(19)4-6-27-21/h10-13,15,18,21-22,27,29-31H,3-9,14H2,1-2H3/t15-,18-,21+,22-/m0/s1
0 references
InChIKey
ZUQMSDOVLNOKGW-XJBIIRKISA-N
0 references
PubChem CID
163184305
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
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