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Mansonone D
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
cadinane sesquiterpenoid
0 references
mass
242.094294308
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₅H₁₄O₃
0 references
canonical SMILES
O=C1C(=O)C(=CC=2C1=C(C=C3OCC(C32)C)C)C
0 references
found in taxon
Ulmus americana
1 reference
stated in
Isolation and identification of six mansonones fromUlmus americana infected withCeratocystis ulmi
Thespesia
1 reference
stated in
Cytotoxic and antibacterial sesquiterpenes from Thespesia populnea
Identifiers
InChI
InChI=1S/C15H14O3/c1-7-5-11-12(9(3)6-18-11)10-4-8(2)14(16)15(17)13(7)10/h4-5,9H,6H2,1-3H3
0 references
InChIKey
LTOSSAVPMIKCBC-UHFFFAOYSA-N
0 references
CAS Registry Number
5090-86-8
0 references
PubChem CID
3083888
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
LTOSSAVPMIKCBC-UHFFFAOYSA-N
SureChEMBL ID
SCHEMBL9863906
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
LTOSSAVPMIKCBC-UHFFFAOYSA-N
UniChem compound ID
548091
1 reference
stated in
UniChem
NMRShiftDB structure ID
20180442
1 reference
matched by identifier from
InChIKey
InChIKey
LTOSSAVPMIKCBC-UHFFFAOYSA-N
DSSTox substance ID
DTXSID80965143
1 reference
matched by identifier from
InChIKey
InChIKey
LTOSSAVPMIKCBC-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID401392820
0 references
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