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(Q126615201)
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English
6,9-Difluoro-11,17-dihydroxy-16-methyl-3,20-dioxopregna-1,4-dien-21-yl 2,2-dimethylpropanoate
group of stereoisomers
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No description defined
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Statements
instance of
group of stereoisomers
0 references
subclass of
chemical compound
0 references
mass
494.2479953119999
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₂₇H₃₆F₂O₆
1 reference
based on heuristic
inferred from SMILES
canonical SMILES
CC1CC2C3CC(C4=CC(=O)C=CC4(C3(C(CC2(C1(C(=O)COC(=O)C(C)(C)C)O)C)O)F)C)F
1 reference
matched by identifier from
InChIKey
InChIKey
JWRMHDSINXPDHB-UHFFFAOYSA-N
stated in
PubChem
PubChem CID
3376
retrieved
13 June 2024
Identifiers
InChI
InChI=1S/C27H36F2O6/c1-14-9-16-17-11-19(28)18-10-15(30)7-8-24(18,5)26(17,29)20(31)12-25(16,6)27(14,34)21(32)13-35-22(33)23(2,3)4/h7-8,10,14,16-17,19-20,31,34H,9,11-13H2,1-6H3
1 reference
matched by identifier from
InChIKey
InChIKey
JWRMHDSINXPDHB-UHFFFAOYSA-N
stated in
PubChem
PubChem CID
3376
retrieved
13 June 2024
InChIKey
JWRMHDSINXPDHB-UHFFFAOYSA-N
1 reference
matched by identifier from
InChIKey
InChIKey
JWRMHDSINXPDHB-UHFFFAOYSA-N
stated in
PubChem
PubChem CID
3376
retrieved
13 June 2024
PubChem CID
3376
1 reference
matched by identifier from
InChIKey
InChIKey
JWRMHDSINXPDHB-UHFFFAOYSA-N
stated in
PubChem
PubChem CID
3376
retrieved
13 June 2024
DSSTox substance ID
DTXSID80859694
1 reference
matched by identifier from
InChIKey
InChIKey
JWRMHDSINXPDHB-UHFFFAOYSA-N
Human Metabolome Database ID
HMDB0254143
1 reference
matched by identifier from
InChIKey
InChIKey
JWRMHDSINXPDHB-UHFFFAOYSA-N
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