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(Q105113644)
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English
(4S,4aR,5S,8S,8aS)-4,8-dihydroxy-3,4a,5-trimethyl-4,5,6,7,8,8a-hexahydrobenzo[f][1]benzofuran-9-one
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
4,8-dihydroxy-3,4a,5-trimethyl-4H,5H,6H,7H,8H,8aH-naphtho[2,3-b]furan-9-one
1 reference
based on heuristic
inferred from SMILES
mass
264.13615912
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
(4S,4aR,5S,8S,8aR)-4,8-dihydroxy-3,4a,5-trimethyl-4,5,6,7,8,8a-hexahydrobenzo[f][1]benzofuran-9-one
1 reference
based on heuristic
inferred from InChI
chemical formula
C₁₅H₂₀O₄
0 references
canonical SMILES
O=C1C=2OC=C(C2C(O)C3(C)C1C(O)CCC3C)C
0 references
isomeric SMILES
Cc1coc2c1[C@@H](O)[C@]1(C)[C@@H](C)CC[C@H](O)[C@H]1C2=O
0 references
found in taxon
Senecio rosmarinifolius
1 reference
stated in
Seco-eremophilanes and other constituents from South African Senecio species
Senecio asperulus
1 reference
stated in
Seco-eremophilanes and other constituents from South African Senecio species
Identifiers
InChI
InChI=1S/C15H20O4/c1-7-6-19-13-10(7)14(18)15(3)8(2)4-5-9(16)11(15)12(13)17/h6,8-9,11,14,16,18H,4-5H2,1-3H3/t8-,9-,11-,14+,15+/m0/s1
0 references
InChIKey
IINQVPBERPRLGN-IOJWWUGISA-N
0 references
PubChem CID
15627965
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
IINQVPBERPRLGN-IOJWWUGISA-N
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