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English
16-Hydroxyalstonisine
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
6-Acetyl-2-hydroxy-1'-methylspiro[4-oxa-12-azatricyclo[7.2.1.02,7]dodec-5-ene-10,3'-indole]-2'-one
1 reference
based on heuristic
inferred from SMILES
mass
354.157957184
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(1S,2S,7S,9S,10S)-6-acetyl-2-hydroxy-1'-methylspiro[4-oxa-12-azatricyclo[7.2.1.02,7]dodec-5-ene-10,3'-indole]-2'-one
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₂₂N₂O₄
0 references
canonical SMILES
O=C(C1=COCC2(O)C3NC(CC12)C4(C(=O)N(C=5C=CC=CC54)C)C3)C
0 references
isomeric SMILES
CC(=O)C1=COC[C@]2(O)[C@H]1C[C@H]1N[C@@H]2C[C@@]12C(=O)N(C)c1ccccc12
0 references
found in taxon
Alstonia macrophylla
1 reference
stated in
New indole alkaloids from Alstonia macrophylla
Identifiers
InChI
InChI=1S/C20H22N2O4/c1-11(23)12-9-26-10-20(25)14(12)7-16-19(8-17(20)21-16)13-5-3-4-6-15(13)22(2)18(19)24/h3-6,9,14,16-17,21,25H,7-8,10H2,1-2H3/t14-,16+,17+,19-,20-/m0/s1
0 references
InChIKey
HXDMVLNKWWFVGR-CIJNOWTPSA-N
0 references
PubChem CID
101730879
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
HXDMVLNKWWFVGR-CIJNOWTPSA-N
UniChem compound ID
97389672
1 reference
stated in
UniChem
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