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Nimbionone
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
6-hydroxy-7-methoxy-1,1,4a-trimethyl-3,4,10,10a-tetrahydrophenanthrene-2,9-dione
1 reference
based on heuristic
inferred from SMILES
mass
302.151809184
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₈H₂₂O₄
0 references
canonical SMILES
O=C1C2=CC(OC)=C(O)C=C2C3(C)CCC(=O)C(C)(C)C3C1
0 references
isomeric SMILES
C[C@]12CCC(=O)C([C@@H]1CC(=O)C3=CC(=C(C=C23)O)OC)(C)C
0 references
found in taxon
Azadirachta indica
1 reference
stated in
Phenolic tricyclic diterpenoids from the bark of Azadirachta indica
Identifiers
InChI
InChI=1S/C18H22O4/c1-17(2)15-9-12(19)10-7-14(22-4)13(20)8-11(10)18(15,3)6-5-16(17)21/h7-8,15,20H,5-6,9H2,1-4H3/t15-,18+/m0/s1
0 references
InChIKey
GIRUCUXRCNBFOL-MAUKXSAKSA-N
0 references
CAS Registry Number
119889-29-1
0 references
PubChem CID
189706
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
GIRUCUXRCNBFOL-MAUKXSAKSA-N
UniChem compound ID
43912790
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID50923134
1 reference
matched by identifier from
InChIKey
InChIKey
GIRUCUXRCNBFOL-MAUKXSAKSA-N
DSSTOX compound identifier
DTXCID701351996
0 references
KNApSAcK ID
C00053559
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
GIRUCUXRCNBFOL-MAUKXSAKSA-N
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