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(Q105287784)
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English
[(1R,2E,5E,9R)-2-formyl-6-methyl-9-[(2S)-6-methylhept-5-en-2-yl]cyclonona-2,5-dien-1-yl]methyl acetate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
[2-Formyl-6-methyl-9-(6-methylhept-5-en-2-yl)cyclonona-2,5-dien-1-yl]methyl acetate
1 reference
based on heuristic
inferred from SMILES
mass
346.250794948
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
[(1R,2E,5E,9S)-2-formyl-6-methyl-9-[(2R)-6-methylhept-5-en-2-yl]cyclonona-2,5-dien-1-yl]methyl acetate
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₂H₃₄O₃
0 references
canonical SMILES
O=CC1=CCC=C(C)CCC(C1COC(=O)C)C(C)CCC=C(C)C
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isomeric SMILES
CC(=O)OC[C@H]1/C(C=O)=C\C/C=C(\C)CC[C@@H]1[C@@H](C)CCC=C(C)C
0 references
found in taxon
Dictyota dichotoma
1 reference
stated in
STRUCTURES AND CONFORMATIONS OF NEW NINE-MEMBERED RING DITERPENOIDS FROM THE MARINE ALGADICTYOTA DICHOTOMA
Identifiers
InChI
InChI=1S/C22H34O3/c1-16(2)8-6-10-18(4)21-13-12-17(3)9-7-11-20(14-23)22(21)15-25-19(5)24/h8-9,11,14,18,21-22H,6-7,10,12-13,15H2,1-5H3/b17-9+,20-11-/t18-,21+,22-/m0/s1
0 references
InChIKey
VKIRISYSFIXHFV-MUFKZDFISA-N
0 references
PubChem CID
23426830
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VKIRISYSFIXHFV-MUFKZDFISA-N
UniChem compound ID
48676928
1 reference
stated in
UniChem
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