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(Q83090078)
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Juzirine
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
isoquinoline alkaloid
0 references
mass
281.10519334
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₁₅NO₃
0 references
canonical SMILES
COC1=C(C=C2C(=C1)C=CN=C2CC3=CC=C(C=C3)O)O
0 references
found in taxon
Xylopia parviflora
2 references
stated in
Secondary and tertiary isoquinoline alkaloids from Xylopia parviflora
stated in
Secondary and tertiary isoquinoline alkaloids from Xylopia parviflora
Ziziphus jujuba
1 reference
stated in
Analysis of alkaloids in the seeds ofZizyphus jujuba by high performance liquid chromatography
Ziziphus spina-christi
1 reference
stated in
Chemical Constituents from the Seeds of Ziziphus jujuba var. spinosa (Bunge) Hu
Identifiers
InChI
InChI=1S/C17H15NO3/c1-21-17-9-12-6-7-18-15(14(12)10-16(17)20)8-11-2-4-13(19)5-3-11/h2-7,9-10,19-20H,8H2,1H3
0 references
InChIKey
XUCRLUHFLBPVRO-UHFFFAOYSA-N
0 references
CAS Registry Number
64069-53-0
1 reference
InChIKey
XUCRLUHFLBPVRO-UHFFFAOYSA-N
stated in
CAS Common Chemistry
retrieved
10 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=64069-53-0
PubChem CID
3085285
1 reference
matched by identifier from
InChIKey
InChIKey
XUCRLUHFLBPVRO-UHFFFAOYSA-N
ChEBI ID
179577
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C17H15NO3/c1-21-17-9-12-6-7-18-15(14(12)10-16(17)20)8-11-2-4-13(19)5-3-11/h2-7,9-10,19-20H,8H2,1H3
UniChem compound ID
32002239
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID20214263
1 reference
matched by identifier from
InChIKey
InChIKey
XUCRLUHFLBPVRO-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID20136754
0 references
Human Metabolome Database ID
HMDB0033954
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
XUCRLUHFLBPVRO-UHFFFAOYSA-N
KNApSAcK ID
C00035166
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
XUCRLUHFLBPVRO-UHFFFAOYSA-N
UNII
HYS6BR39QH
1 reference
matched by identifier from
InChIKey
InChIKey
XUCRLUHFLBPVRO-UHFFFAOYSA-N
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