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(Q72507270)
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English
Secologanin dimethyl acetal
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
434.17881178
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₉H₃₀O₁₁
0 references
canonical SMILES
O=C(OC)C1=COC(OC2OC(CO)C(O)C(O)C2O)C(C=C)C1CC(OC)OC
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isomeric SMILES
COC(C[C@H]1[C@H]([C@@H](OC=C1C(=O)OC)O[C@H]2[C@@H]([C@H]([C@@H]([C@H](O2)CO)O)O)O)C=C)OC
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found in taxon
Sinoadina racemosa
1 reference
stated in
Six secoiridoid glucosides from Adina racemosa
Lonicera japonica
2 references
stated in
Secoiridoid glycosides from the flower buds of Lonicera japonica
stated in
Iridoid glucosides from Lonicera japonica THUNB.
Strychnos spinosa
1 reference
stated in
Secoiridoid glucosides from Strychnos spinosa
Lonicera caerulea
1 reference
stated in
Caeruleosides A and B, bis-iridoid glucosides from Lonicera caerulea
Sphenoclea zeylanica
1 reference
stated in
Allelochemicals of the tropical weed Sphenoclea zeylanica
Hydrangea serrata
1 reference
stated in
Secoiridoid glycosides from the leaves of Hydrangea macrophylla subsp. serrata
Identifiers
InChI
InChI=1S/C19H30O11/c1-5-9-10(6-13(25-2)26-3)11(17(24)27-4)8-28-18(9)30-19-16(23)15(22)14(21)12(7-20)29-19/h5,8-10,12-16,18-23H,1,6-7H2,2-4H3/t9-,10+,12-,14-,15+,16-,18+,19+/m1/s1
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InChIKey
HUVIXLWRQSMCLN-PXRCHJMLSA-N
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CAS Registry Number
77988-07-9
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PubChem CID
157140
1 reference
matched by identifier from
InChIKey
InChIKey
HUVIXLWRQSMCLN-PXRCHJMLSA-N
UniChem compound ID
25455
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID60228642
1 reference
matched by identifier from
InChIKey
InChIKey
HUVIXLWRQSMCLN-PXRCHJMLSA-N
DSSTOX compound identifier
DTXCID10151133
0 references
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