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(Q105173897)
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English
4'-Hydroxy-1',3,4'-trimethyl-5-(2-methylprop-1-enyl)-6'-oxospiro[oxolane-2,12'-tricyclo[9.3.0.03,7]tetradec-8-ene]-8'-carbaldehyde
group of stereoisomers with the chemical formula C₂₅H₃₆O₄
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Statements
instance of
group of stereoisomers
0 references
subclass of
ophiobolane sesterterpenoid
1 reference
inferred from
ophiobolane sesterterpenoid
mass
400.261359632
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₅H₃₆O₄
0 references
canonical SMILES
O=CC1=CCC2C3(OC(C=C(C)C)CC3C)CCC2(C)CC4C1C(=O)CC4(O)C
0 references
found in taxon
Bipolaris oryzae
2 references
stated in
Structures of cochlioquinones A and B, new metabolites of Cochliobolus miyabeanus: chemical and X-ray crystallographic determination
stated in
Characterization of 6-epi-3-anhydroophiobolin B from Cochliobolus heterostrophus
Identifiers
InChI
InChI=1S/C25H36O4/c1-15(2)10-18-11-16(3)25(29-18)9-8-23(4)12-19-22(20(27)13-24(19,5)28)17(14-26)6-7-21(23)25/h6,10,14,16,18-19,21-22,28H,7-9,11-13H2,1-5H3
0 references
InChIKey
MWYYLZRWWNBROW-UHFFFAOYSA-N
0 references
PubChem CID
4598
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
MWYYLZRWWNBROW-UHFFFAOYSA-N
UniChem compound ID
64602778
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0250395
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
MWYYLZRWWNBROW-UHFFFAOYSA-N
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