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(Q105006086)
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English
3-[(E)-5-[(1R,4aR,8aR)-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]-3-methylpent-2-enoxy]-3-oxopropanoic acid
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
3-[5-(5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl)-3-methylpent-2-enoxy]-3-oxopropanoic acid
1 reference
based on heuristic
inferred from SMILES
mass
376.261359632
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₃H₃₆O₄
0 references
canonical SMILES
O=C(O)CC(=O)OCC=C(C)CCC1C(=C)CCC2C(C)(C)CCCC12C
0 references
isomeric SMILES
C=C1CC[C@@H]2C(C)(C)CCC[C@@]2(C)[C@@H]1CC/C(C)=C/COC(=O)CC(=O)O
0 references
found in taxon
Nardia succulenta
1 reference
stated in
Diterpene malonates and other terpenes from Nardia succulenta and N. scalaris
Identifiers
InChI
InChI=1S/C23H36O4/c1-16(11-14-27-21(26)15-20(24)25)7-9-18-17(2)8-10-19-22(3,4)12-6-13-23(18,19)5/h11,18-19H,2,6-10,12-15H2,1,3-5H3,(H,24,25)/b16-11+/t18-,19-,23+/m1/s1
0 references
InChIKey
GBTQZZZCLLAVKN-GYFDDLDESA-N
0 references
PubChem CID
162846228
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
GBTQZZZCLLAVKN-GYFDDLDESA-N
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