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Pimara-7,15-diene
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
pimarane diterpenoid
1 reference
based on heuristic
inferred from SMILES
mass
272.250401024
dalton
1 reference
based on heuristic
inferred from isomeric SMILES
stereoisomer of
syn-isopimara-7,15-diene
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(2R,4aR,4bR,8aR)-2-ethenyl-2,4b,8,8-tetramethyl-3,4,4a,5,6,7,8a,9-octahydro-1H-phenanthrene
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
(2S,4aS,4bS,8aR)-2-ethenyl-2,4b,8,8-tetramethyl-3,4,4a,5,6,7,8a,9-octahydro-1H-phenanthrene
1 reference
based on heuristic
inferred from InChI
pimara-7,15-diene
1 reference
based on heuristic
inferred from InChI
9beta-pimara-7,15-diene
1 reference
based on heuristic
inferred from InChI
(2R,4As,4bS,8aS)-2-ethenyl-2,4b,8,8-tetramethyl-3,4,4a,5,6,7,8a,9-octahydro-1H-phenanthrene
1 reference
based on heuristic
inferred from InChI
isopimara-7,15-diene
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₀H₃₂
0 references
canonical SMILES
C=CC1(C)CCC2C(=CCC3C(C)(C)CCCC23C)C1
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
C[C@@]1(CC[C@@H]2C(=CC[C@H]3[C@@]2(CCCC3(C)C)C)C1)C=C
0 references
Identifiers
InChI
InChI=1S/C20H32/c1-6-19(4)13-10-16-15(14-19)8-9-17-18(2,3)11-7-12-20(16,17)5/h6,8,16-17H,1,7,9-14H2,2-5H3/t16-,17-,19+,20-/m1/s1
0 references
InChIKey
VCOVNILQQQZROK-IZBJGVDFSA-N
0 references
CAS Registry Number
21561-91-1
0 references
PubChem CID
192993
1 reference
matched by identifier from
InChIKey
InChIKey
VCOVNILQQQZROK-IZBJGVDFSA-N
UniChem compound ID
67871532
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID90944166
1 reference
matched by identifier from
InChIKey
InChIKey
VCOVNILQQQZROK-IZBJGVDFSA-N
DSSTOX compound identifier
DTXCID001372519
0 references
Human Metabolome Database ID
HMDB0301825
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
VCOVNILQQQZROK-IZBJGVDFSA-N
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