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(Q105018590)
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English
methyl (1R,4aS,7S,10aR)-7-ethenyl-1,4a,7-trimethyl-3,4,5,6,8,9,10,10a-octahydro-2H-phenanthrene-1-carboxylate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
methyl 7-ethenyl-1,4a,7-trimethyl-3,4,5,6,8,9,10,10a-octahydro-2H-phenanthrene-1-carboxylate
1 reference
based on heuristic
inferred from SMILES
mass
316.240230264
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₁H₃₂O₂
0 references
canonical SMILES
O=C(OC)C1(C)CCCC2(C3=C(CCC12)CC(C=C)(C)CC3)C
0 references
isomeric SMILES
C=C[C@@]1(C)CCC2=C(CC[C@@H]3[C@]2(C)CCC[C@@]3(C)C(=O)OC)C1
0 references
found in taxon
Cleonia lusitanica
1 reference
stated in
Cleonioic acid, a new diterpenoid from Cleonia lusitanica
Identifiers
InChI
InChI=1S/C21H32O2/c1-6-19(2)13-10-16-15(14-19)8-9-17-20(16,3)11-7-12-21(17,4)18(22)23-5/h6,17H,1,7-14H2,2-5H3/t17-,19+,20-,21-/m1/s1
0 references
InChIKey
GTFNGUBYWRFHMR-GFOJFJKKSA-N
0 references
PubChem CID
13877500
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
GTFNGUBYWRFHMR-GFOJFJKKSA-N
UniChem compound ID
63873932
1 reference
stated in
UniChem
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