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(Q105339881)
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English
(3E,4R)-3-(15-Hexadecyn-1-ylidene)dihydro-4beta-hydroxy-5alpha-methyl-2(3H)-furanone
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
3-(hexadec-15-yn-1-ylidene)-4-hydroxy-5-methyloxolan-2-one
1 reference
based on heuristic
inferred from SMILES
mass
334.250794948
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(3E,4R,5S)-3-hexadec-15-ynylidene-4-hydroxy-5-methyloxolan-2-one
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(3Z,4S)-3-(15-Hexadecyn-1-ylidene)dihydro-4alpha-hydroxy-5alpha-methyl-2(3H)-furanone
1 reference
based on heuristic
inferred from InChI
(3E,4S,5S)-3-hexadec-15-ynylidene-4-hydroxy-5-methyloxolan-2-one
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₁H₃₄O₃
0 references
canonical SMILES
O=C1OC(C)C(O)C1=CCCCCCCCCCCCCCC#C
0 references
isomeric SMILES
C#CCCCCCCCCCCCCC/C=C1\C(=O)O[C@@H](C)[C@@H]1O
0 references
found in taxon
Mezilaurus mahuba
1 reference
stated in
ω-ethyl, ω-ethenyl and ω-ethynyl-α-alkylidene-γ-lactones from Clinostemon mahuba
Identifiers
InChI
InChI=1S/C21H34O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-19-20(22)18(2)24-21(19)23/h1,17-18,20,22H,4-16H2,2H3/b19-17-/t18-,20-/m0/s1
0 references
InChIKey
XQMNRPUXUUOJTM-VMNXEWPISA-N
0 references
PubChem CID
101643340
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
XQMNRPUXUUOJTM-VMNXEWPISA-N
UniChem compound ID
96719937
1 reference
stated in
UniChem
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