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(Q104964135)
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English
Isoinophynone
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
5-hydroxy-2,3,8,8-tetramethyl-6-(1-phenylethenyl)-2H,3H-pyrano[2,3-f]chromen-4-one
1 reference
based on heuristic
inferred from SMILES
mass
376.167459248
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
Inophynone
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(2S,3R)-5-Hydroxy-6-(1-phenylethenyl)-2,3,8,8-tetramethyl-2H,8H-benzo[1,2-b:3,4-b']dipyran-4(3H)-one
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(2S,3S)-5-hydroxy-2,3,8,8-tetramethyl-6-(1-phenylethenyl)-2,3-dihydropyrano[2,3-h]chromen-4-one
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₂₄H₂₄O₄
0 references
canonical SMILES
O=C1C=2C(O)=C(C=3OC(C=CC3C2OC(C)C1C)(C)C)C(=C)C=4C=CC=CC4
0 references
isomeric SMILES
C=C(c1ccccc1)c1c(O)c2c(c3c1OC(C)(C)C=C3)O[C@H](C)[C@H](C)C2=O
0 references
found in taxon
Alexandrian laurel
1 reference
stated in
Epimers from the leaves of Calophyllum inophyllum
Identifiers
InChI
InChI=1S/C24H24O4/c1-13-15(3)27-22-17-11-12-24(4,5)28-23(17)18(21(26)19(22)20(13)25)14(2)16-9-7-6-8-10-16/h6-13,15,26H,2H2,1,3-5H3/t13-,15+/m0/s1
0 references
InChIKey
CLZBUZYFEDJSCK-DZGCQCFKSA-N
0 references
PubChem CID
5318576
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
CLZBUZYFEDJSCK-DZGCQCFKSA-N
UniChem compound ID
53100734
1 reference
stated in
UniChem
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