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(Q104985303)
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English
(1S,4R,5S,7aR)-2,4,5,6,7,7a-Hexahydro-1,5-dimethyl-4-(2-methyl-1-propen-1-yl)-1H-indene
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
(+)-1(9),10-Pacifigorgiadiene
1 reference
based on heuristic
inferred from SMILES
mass
204.187800768
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(+)-Pacifigorgia-1(9),10-diene
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₄
0 references
canonical SMILES
C1=C2C(C=C(C)C)C(C)CCC2C(C)C1
0 references
isomeric SMILES
CC(C)=C[C@@H]1C2=CC[C@H](C)[C@H]2CC[C@@H]1C
0 references
found in taxon
Frullania fragilifolia
1 reference
stated in
Pacifigorgianes and tamariscene as constituents of Frullania tamarisci and Valeriana officinalis
Frullania tamarisci
1 reference
stated in
Pacifigorgianes and tamariscene as constituents of Frullania tamarisci and Valeriana officinalis
Valeriana officinalis
1 reference
stated in
Pacifigorgianes and tamariscene as constituents of Frullania tamarisci and Valeriana officinalis
Identifiers
InChI
InChI=1S/C15H24/c1-10(2)9-15-12(4)5-7-13-11(3)6-8-14(13)15/h8-9,11-13,15H,5-7H2,1-4H3/t11-,12-,13+,15-/m0/s1
0 references
InChIKey
DMSFMSTWAVYMQU-XPCVCDNBSA-N
0 references
CAS Registry Number
351222-62-3
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
12051850
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
DMSFMSTWAVYMQU-XPCVCDNBSA-N
UniChem compound ID
96696236
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID101125187
1 reference
matched by identifier from
InChIKey
InChIKey
DMSFMSTWAVYMQU-XPCVCDNBSA-N
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