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(Q105214809)
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English
(4aS)-6,6,8-Trimethyl-4a,5,6,7-tetrahydro-4H-indeno[5,6-c]furan-1-carboxylic acid
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
6,6,8-Trimethyl-4,4a,5,7-tetrahydrocyclopenta[f][2]benzofuran-1-carboxylic acid
1 reference
based on heuristic
inferred from SMILES
mass
246.125594436
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₁₈O₃
0 references
canonical SMILES
O=C(O)C=1OC=C2C1C(=C3CC(C)(C)CC3C2)C
0 references
isomeric SMILES
CC1=C2CC(C)(C)C[C@H]2Cc2coc(C(=O)O)c21
0 references
found in taxon
Laurilia
2 references
stated in
Isolation and structure elucidation of tsugicolines F-H, novel furosesquiterpenes, and tsugicoline I from the fungus Laurilia tsugicola
stated in
Isolation and structure elucidation of tsugicolines F-H, novel furosesquiterpenes, and tsugicoline I from the fungus Laurilia tsugicola
Identifiers
InChI
InChI=1S/C15H18O3/c1-8-11-6-15(2,3)5-9(11)4-10-7-18-13(12(8)10)14(16)17/h7,9H,4-6H2,1-3H3,(H,16,17)/t9-/m1/s1
0 references
InChIKey
PTPNJDWWPAJMFA-SECBINFHSA-N
0 references
PubChem CID
10514564
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
PTPNJDWWPAJMFA-SECBINFHSA-N
ChEBI ID
215113
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C15H18O3/c1-8-11-6-15(2,3)5-9(11)4-10-7-18-13(12(8)10)14(16)17/h7,9H,4-6H2,1-3H3,(H,16,17)/t9-/m1/s1
UniChem compound ID
34158714
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA019441
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
PTPNJDWWPAJMFA-SECBINFHSA-N
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