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(Q82951498)
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English
Ethyl 10,13-dimethyl-3,5'-dioxo-1,2,3,8,9,10,11,12,13,14,15,16-dodecahydrospiro[cyclopenta[a]phenanthrene-17,2'-oxolane]-4'-carboxylate
group of stereoisomers with the chemical formula C₂₅H₃₂O₅
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
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mass
412.2249741239999
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₅H₃₂O₅
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CCOC(=O)C1CC2(CCC3C4C=CC5=CC(=O)CCC5(C)C4CCC32C)OC1=O
1 reference
based on heuristic
inferred from isomeric SMILES
isomeric SMILES
CCOC(=O)C1C[C@@]2(CC[C@H]3[C@@H]4C=CC5=CC(=O)CC[C@]5(C)[C@H]4CC[C@@]32C)OC1=O
1 reference
based on heuristic
inferred from InChI
Identifiers
InChI
InChI=1S/C25H32O5/c1-4-29-21(27)18-14-25(30-22(18)28)12-9-20-17-6-5-15-13-16(26)7-10-23(15,2)19(17)8-11-24(20,25)3/h5-6,13,17-20H,4,7-12,14H2,1-3H3/t17-,18?,19+,20+,23+,24+,25-/m1/s1
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InChIKey
UDYXOLXWRPSMNQ-GUVWBQEASA-N
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CAS Registry Number
53866-20-9
1 reference
InChIKey
UDYXOLXWRPSMNQ-GUVWBQEASA-N
stated in
CAS Common Chemistry
retrieved
10 April 2021
reference URL
https://commonchemistry.cas.org/detail?cas_rn=53866-20-9
PubChem CID
104627
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
UniChem compound ID
62700177
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID80968639
0 references
DSSTOX compound identifier
DTXCID801396212
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