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Pipereicosalidine
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
piperidine alkaloids
0 references
mass
373.334464996
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₅H₄₃NO
0 references
canonical SMILES
O=C(C=CC=CCCCCCCCCCCC=CCCC)N1CCCCC1
0 references
isomeric SMILES
CCC/C=C\CCCCCCCCCC/C=C/C=C/C(=O)N1CCCCC1
0 references
found in taxon
Piper retrofractum
2 references
stated in
Piperidine alkaloids from Piper retrofractum fruits
stated in
Piperidine alkaloids from Piper retrofractum fruits
Identifiers
InChI
InChI=1S/C25H43NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-22-25(27)26-23-20-18-21-24-26/h4-5,16-17,19,22H,2-3,6-15,18,20-21,23-24H2,1H3/b5-4-,17-16+,22-19+
0 references
InChIKey
MKEWSYYOWWKTAK-AEPHKGLBSA-N
0 references
CAS Registry Number
145237-20-3
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
101634668
1 reference
matched by identifier from
InChIKey
InChIKey
MKEWSYYOWWKTAK-AEPHKGLBSA-N
ChEBI ID
174961
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C25H43NO/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-22-25(27)26-23-20-18-21-24-26/h4-5,16-17,19,22H,2-3,6-15,18,20-21,23-24H2,1H3/b5-4-,17-16+,22-19+
UniChem compound ID
32013135
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID401213957
1 reference
matched by identifier from
InChIKey
InChIKey
MKEWSYYOWWKTAK-AEPHKGLBSA-N
Human Metabolome Database ID
HMDB0039738
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
MKEWSYYOWWKTAK-AEPHKGLBSA-N
KNApSAcK ID
C00057068
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
MKEWSYYOWWKTAK-AEPHKGLBSA-N
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