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(Q115968173)
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English
[4-hydroxy-4-(hydroxymethyl)-4a,8,8-trimethyl-5,6,7,8a-tetrahydro-1H-naphthalen-1-yl] octa-2,4,6-trienoate
group of stereoisomers with the chemical formula C₂₂H₃₂O₄
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
360.230059504
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₂H₃₂O₄
0 references
canonical SMILES
O=C(OC1C=CC(O)(CO)C2(C)CCCC(C)(C)C12)C=CC=CC=CC
0 references
found in taxon
Aspergillus ustus
1 reference
stated in
Sesquiterpenoids and benzofuranoids from the marine-derived fungus Aspergillus ustus 094102.
Identifiers
InChI
InChI=1S/C22H32O4/c1-5-6-7-8-9-11-18(24)26-17-12-15-22(25,16-23)21(4)14-10-13-20(2,3)19(17)21/h5-9,11-12,15,17,19,23,25H,10,13-14,16H2,1-4H3
0 references
InChIKey
KKQZGPSOJHPQNX-UHFFFAOYSA-N
0 references
PubChem CID
75224811
2 references
stated in
PubChem
retrieved
3 January 2023
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
KKQZGPSOJHPQNX-UHFFFAOYSA-N
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