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(Q104990365)
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English
methyl (1S,4aR,5S,8aR)-5-[2-(furan-3-yl)-2-oxoethyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
methyl 5-[2-(furan-3-yl)-2-oxoethyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylate
1 reference
based on heuristic
inferred from SMILES
mass
344.198759376
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
Methyl 15,16-epoxy-12-oxo-8(20),13(16),14-ent-labdatrien-19-oate
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
methyl (1R,4aS,5R,8aS)-5-[2-(furan-3-yl)-2-oxoethyl]-1,4a-dimethyl-6-methylidene-3,4,5,7,8,8a-hexahydro-2H-naphthalene-1-carboxylate
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₁H₂₈O₄
0 references
canonical SMILES
O=C(OC)C1(C)CCCC2(C)C(C(=C)CCC12)CC(=O)C3=COC=C3
0 references
isomeric SMILES
C=C1CC[C@H]2[C@@](C)(C(=O)OC)CCC[C@]2(C)[C@H]1CC(=O)c1ccoc1
0 references
found in taxon
Sciadopitys verticillata
1 reference
stated in
Diterpenes from the seed of Sciadopitys verticillata
Identifiers
InChI
InChI=1S/C21H28O4/c1-14-6-7-18-20(2,9-5-10-21(18,3)19(23)24-4)16(14)12-17(22)15-8-11-25-13-15/h8,11,13,16,18H,1,5-7,9-10,12H2,2-4H3/t16-,18+,20+,21-/m0/s1
0 references
InChIKey
DVUUHZNLLSLOKO-QAKNJHSXSA-N
0 references
PubChem CID
15887521
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
DVUUHZNLLSLOKO-QAKNJHSXSA-N
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