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(Q105002229)
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Terrestrol K
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
2-chloro-4,5-dihydroxy-6-methylcyclohex-2-en-1-one
1 reference
based on heuristic
inferred from SMILES
mass
176.024021828
dalton
1 reference
based on heuristic
inferred from SMILES
stereoisomer of
Terrestrol L
2 references
based on heuristic
inferred from InChIKey
based on heuristic
inferred from InChI
chemical formula
C₇H₉ClO₃
0 references
canonical SMILES
O=C1C(Cl)=CC(O)C(O)C1C
0 references
isomeric SMILES
C[C@H]1C(=O)C(Cl)=C[C@H](O)[C@H]1O
0 references
found in taxon
Penicillium terrestre
1 reference
stated in
Chloctanspirones A and B, novel chlorinated polyketides with an unprecedented skeleton, from marine sediment derived fungus Penicillium terrestre
Penicillium solitum
1 reference
stated in
Chloctanspirones A and B, novel chlorinated polyketides with an unprecedented skeleton, from marine sediment derived fungus Penicillium terrestre
Identifiers
InChI
InChI=1S/C7H9ClO3/c1-3-6(10)4(8)2-5(9)7(3)11/h2-3,5,7,9,11H,1H3/t3-,5-,7-/m0/s1
0 references
InChIKey
FVAPDNPZMMPASW-XUJUNTFYSA-N
0 references
PubChem CID
54772160
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
FVAPDNPZMMPASW-XUJUNTFYSA-N
ChEBI ID
226970
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C7H9ClO3/c1-3-6(10)4(8)2-5(9)7(3)11/h2-3,5,7,9,11H,1H3/t3-,5-,7-/m0/s1
UniChem compound ID
33765849
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA017423
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
FVAPDNPZMMPASW-XUJUNTFYSA-N
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