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(Q104952839)
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English
Officinaruminane A
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
pyridine alkaloids
0 references
mass
551.282429424
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₉H₃₇NO₂
0 references
canonical SMILES
O=C(C=1C=C(C(=O)CCC=2C=CC=CC2)C(=NC1CCC=3C=CC=CC3)CCC=4C=CC=CC4)CCC=5C=CC=CC5
0 references
found in taxon
Alpinia officinarum
1 reference
stated in
New diarylheptanoids from the rhizome of Alpinia officinarum Hance
Identifiers
InChI
InChI=1S/C39H37NO2/c41-38(27-23-32-17-9-3-10-18-32)34-29-35(39(42)28-24-33-19-11-4-12-20-33)37(26-22-31-15-7-2-8-16-31)40-36(34)25-21-30-13-5-1-6-14-30/h1-20,29H,21-28H2
0 references
InChIKey
CBTOVLLQCAVBSN-UHFFFAOYSA-N
0 references
PubChem CID
102163190
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
UniChem compound ID
101046333
1 reference
stated in
UniChem
KNApSAcK ID
C00054126
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
CBTOVLLQCAVBSN-UHFFFAOYSA-N
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