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(Q82956362)
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English
9-Hydroxy-3,8,11b-trimethyltetradecahydro-6a,9-methanocyclohepta[a]naphthalene-3-carboxylic acid
chemical compound
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
320.23514488399996
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₀H₃₂O₃
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CC1CC23CCC4CC(C)(C(=O)O)CCC4(C)C2CCC1(O)C3
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
C[C@H]1C[C@@]23CCC4C[C@](C)(C(=O)O)CC[C@@]4(C)[C@@H]2CC[C@]1(O)C3
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C20H32O3/c1-13-10-19-6-4-14-11-17(2,16(21)22)8-9-18(14,3)15(19)5-7-20(13,23)12-19/h13-15,23H,4-12H2,1-3H3,(H,21,22)/t13-,14?,15-,17+,18+,19+,20-/m0/s1
0 references
InChIKey
OGHMLISGZARJGS-QSASEQBESA-N
0 references
CAS Registry Number
5711-16-0
0 references
PubChem CID
56843947
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
61641743
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID80972579
0 references
DSSTOX compound identifier
DTXCID601400049
0 references
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