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(Q82636117)
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English
(8R,9R,10S,13S,14S)-Hexadecahydrospiro[cyclopenta[a]phenanthrene-17,5'-[1,2,3]oxathiazolidine]
group of stereoisomers with the chemical formula C₁₈H₂₉NOS
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
307.196985548
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₈H₂₉NOS
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
C1CCC2C(C1)CCC1C2CCC2C1CCC21CNSO1
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
C1CC[C@H]2C(C1)CC[C@@H]1[C@@H]2CC[C@H]2[C@H]1CCC21CNSO1
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C18H29NOS/c1-2-4-13-12(3-1)5-6-15-14(13)7-8-17-16(15)9-10-18(17)11-19-21-20-18/h12-17,19H,1-11H2/t12?,13-,14+,15+,16-,17-,18?/m0/s1
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InChIKey
FWRVZKRUVSHCMR-OJIMNTFYSA-N
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CAS Registry Number
81142-76-9
0 references
PubChem CID
53472109
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
68778505
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60703848
0 references
DSSTOX compound identifier
DTXCID90654596
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