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(Q82877476)
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English
methyl 3-[(3aR,5aR,6S,7S,9aR,9bR)-9a,9b-dimethyl-7-prop-1-en-2-yl-3a,4,5,5a,6,7,8,9-octahydro-1H-cyclopenta[a]naphthalen-6-yl]propanoate
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
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mass
330.255880328
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₂H₃₄O₂
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canonical SMILES
O=C(OC)CCC1C(C(=C)C)CCC2(C)C1CCC3C=CCC32C
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isomeric SMILES
CC(=C)[C@H]1CC[C@@]2([C@@H]([C@H]1CCC(=O)OC)CC[C@H]3[C@]2(CC=C3)C)C
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found in taxon
Commiphora kua
1 reference
stated in
Anti-inflammatory activity of resins from some species of the plant family Burseraceae
Identifiers
InChI
InChI=1S/C22H34O2/c1-15(2)17-12-14-22(4)19(18(17)9-11-20(23)24-5)10-8-16-7-6-13-21(16,22)3/h6-7,16-19H,1,8-14H2,2-5H3/t16-,17+,18-,19+,21+,22+/m0/s1
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InChIKey
GZLOULXNCLGCGH-MYBSLXOZSA-N
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CAS Registry Number
102848-63-5
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PubChem CID
128211
1 reference
matched by identifier from
InChIKey
InChIKey
GZLOULXNCLGCGH-MYBSLXOZSA-N
UniChem compound ID
59001984
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID70908089
1 reference
matched by identifier from
InChIKey
InChIKey
GZLOULXNCLGCGH-MYBSLXOZSA-N
DSSTOX compound identifier
DTXCID301337176
0 references
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