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(Q105148145)
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English
(1S,3aR,5Z,9E,12aS)-3a,6,10-trimethyl-1-prop-1-en-2-yl-2,3,4,7,8,11,12,12a-octahydro-1H-cyclopenta[11]annulene
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
3a,6,10-trimethyl-1-prop-1-en-2-yl-2,3,4,7,8,11,12,12a-octahydro-1H-cyclopenta[11]annulene
1 reference
based on heuristic
inferred from SMILES
mass
272.250401024
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(1S,3aR,5E,9Z,12aS)-3a,6,10-trimethyl-1-prop-1-en-2-yl-2,3,4,7,8,11,12,12a-octahydro-1H-cyclopenta[11]annulene
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(1S,3aR,9E,12aS)-3a,6,10-trimethyl-1-prop-1-en-2-yl-2,3,4,7,8,11,12,12a-octahydro-1H-cyclopenta[11]annulene
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(1R,3E,7E,11S,12S)-3,7,18-Dolabellatriene
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(1R,3aS,5Z,9E,12aR)-3a,6,10-trimethyl-1-prop-1-en-2-yl-2,3,4,7,8,11,12,12a-octahydro-1H-cyclopenta[11]annulene
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₃₂
0 references
canonical SMILES
C=C(C)C1CCC2(C)CC=C(C)CCC=C(C)CCC12
0 references
isomeric SMILES
C=C(C)[C@H]1CC[C@]2(C)C/C=C(/C)CC/C=C(\C)CC[C@@H]12
0 references
found in taxon
Cyperus alopecuroides
1 reference
stated in
Constituents of the essential oil of Cyperus alopecuroides
Identifiers
InChI
InChI=1S/C20H32/c1-15(2)18-12-14-20(5)13-11-17(4)8-6-7-16(3)9-10-19(18)20/h7,11,18-19H,1,6,8-10,12-14H2,2-5H3/b16-7+,17-11-/t18-,19+,20+/m1/s1
0 references
InChIKey
KZHMFCYCMBPVGZ-KQVVSONPSA-N
0 references
PubChem CID
162870935
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
KZHMFCYCMBPVGZ-KQVVSONPSA-N
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