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(Q105274831)
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English
19S-Hydroxytacamine
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
eburna / tacaman alkaloid
0 references
mass
370.189257312
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₂₆N₂O₄
0 references
canonical SMILES
O=C(OC)C1(O)N2C=3C=CC=CC3C4=C2C5N(CC4)CC(CC5C1)C(O)C
0 references
isomeric SMILES
COC(=O)[C@]1(O)C[C@H]2C[C@@H]([C@H](C)O)CN3CCc4c(n1c1ccccc41)[C@@H]23
0 references
found in taxon
Tabernaemontana eglandulosa
1 reference
stated in
Alkaloids of Tabernaemontana eglandulosa
Identifiers
InChI
InChI=1S/C21H26N2O4/c1-12(24)14-9-13-10-21(26,20(25)27-2)23-17-6-4-3-5-15(17)16-7-8-22(11-14)18(13)19(16)23/h3-6,12-14,18,24,26H,7-11H2,1-2H3/t12-,13+,14+,18+,21+/m0/s1
0 references
InChIKey
UKQXOQIRZSCMSF-KKAMHHQWSA-N
0 references
PubChem CID
11089992
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
UKQXOQIRZSCMSF-KKAMHHQWSA-N
UniChem compound ID
32798162
1 reference
stated in
UniChem
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