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(Q105252990)
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English
digoxigenin
group of stereoisomers
digoxigenin (stereochemistry unspecified)
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Statements
instance of
group of stereoisomers
0 references
subclass of
cardanolides
1 reference
inferred from
cardanolides
mass
390.24062418799986
dalton
1 reference
based on heuristic
inferred from InChI
chemical formula
C₂₃H₃₄O₅
0 references
canonical SMILES
O=C1OCC(=C1)C2CCC3(O)C4CCC5CC(O)CCC5(C)C4CC(O)C23C
0 references
Identifiers
InChI
InChI=1S/C23H34O5/c1-21-7-5-15(24)10-14(21)3-4-17-18(21)11-19(25)22(2)16(6-8-23(17,22)27)13-9-20(26)28-12-13/h9,14-19,24-25,27H,3-8,10-12H2,1-2H3
0 references
InChIKey
SHIBSTMRCDJXLN-UHFFFAOYSA-N
0 references
PubChem CID
608640
1 reference
based on heuristic
inferred from InChIKey
ChEBI ID
181806
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C23H34O5/c1-21-7-5-15(24)10-14(21)3-4-17-18(21)11-19(25)22(2)16(6-8-23(17,22)27)13-9-20(26)28-12-13/h9,14-19,24-25,27H,3-8,10-12H2,1-2H3
UniChem compound ID
29667373
1 reference
stated in
UniChem
Probes And Drugs ID
PD075340
0 references
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