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(Q110076817)
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English
Murrayacinine
group of stereoisomers with the chemical formula C₂₃H₂₃NO₂
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
345.172878976
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₃H₂₃NO₂
0 references
canonical SMILES
O=CC=1C=C2C=3C=CC=CC3NC2=C4C=CC(OC14)(C)CCC=C(C)C
0 references
found in taxon
Murraya koenigii
1 reference
stated in
Terpenoid alkaloids fromMurraya koenigii Spreng. IV Structure and synthesis of mahanimbinine
Identifiers
InChI
InChI=1S/C23H23NO2/c1-15(2)7-6-11-23(3)12-10-18-21-19(13-16(14-25)22(18)26-23)17-8-4-5-9-20(17)24-21/h4-5,7-10,12-14,24H,6,11H2,1-3H3
0 references
InChIKey
VEZSSHVWEILOAM-UHFFFAOYSA-N
0 references
CAS Registry Number
53508-00-2
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
102219164
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VEZSSHVWEILOAM-UHFFFAOYSA-N
ChEBI ID
168925
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C23H23NO2/c1-15(2)7-6-11-23(3)12-10-18-21-19(13-16(14-25)22(18)26-23)17-8-4-5-9-20(17)24-21/h4-5,7-10,12-14,24H,6,11H2,1-3H3
UniChem compound ID
32008716
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID701125054
1 reference
matched by identifier from
InChIKey
InChIKey
VEZSSHVWEILOAM-UHFFFAOYSA-N
Human Metabolome Database ID
HMDB0030224
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VEZSSHVWEILOAM-UHFFFAOYSA-N
KNApSAcK ID
C00054821
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VEZSSHVWEILOAM-UHFFFAOYSA-N
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