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(Q110178179)
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English
(1S,4aR,5S,8aR)-5-[[(2S,3R)-3-ethenyl-3-methyloxiran-2-yl]methyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylic acid
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
labdanes
1 reference
based on heuristic
inferred from SMILES
mass
318.21949482
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(1S,4aR)-1beta-[[(2S,3S)-3-Vinyl-3-methyloxiranyl]methyl]-2-methylene-5,8abeta-dimethyldecahydronaphthalene-5beta-carboxylic acid
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₂₀H₃₀O₃
0 references
canonical SMILES
O=C(O)C1(C)CCCC2(C)C(C(=C)CCC12)CC3OC3(C=C)C
0 references
isomeric SMILES
C=C[C@@]1(C)O[C@H]1C[C@H]1C(=C)CC[C@H]2[C@@](C)(C(=O)O)CCC[C@]12C
0 references
found in taxon
Fokienia hodginsii
1 reference
stated in
Diterpenoids from the twigs and leaves of Fokienia hodginsii
Identifiers
InChI
InChI=1S/C20H30O3/c1-6-20(5)16(23-20)12-14-13(2)8-9-15-18(14,3)10-7-11-19(15,4)17(21)22/h6,14-16H,1-2,7-12H2,3-5H3,(H,21,22)/t14-,15+,16-,18+,19-,20+/m0/s1
0 references
InChIKey
WGURGXZGVSMKKG-YDMLNEHTSA-N
0 references
PubChem CID
71725777
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
WGURGXZGVSMKKG-YDMLNEHTSA-N
UniChem compound ID
56184180
1 reference
stated in
UniChem
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