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Aristolochic acid-D
chemical compound
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No label defined
No description defined
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Statements
instance of
type of chemical entity
0 references
subclass of
aristolochic acids
0 references
mass
357.048466312
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₇H₁₁NO₈
0 references
canonical SMILES
COC1=CC(=CC2=C3C(=C(C=C12)[N+](=O)[O-])C(=CC4=C3OCO4)C(=O)O)O
0 references
found in taxon
Aristolochia kaempferi
1 reference
stated in
The constituents of the root and stem of Aristolochia heterophylla Hemsl
Aristolochia heterophylla
1 reference
stated in
The constituents of the root and stem of Aristolochia heterophylla Hemsl
Isotrema mollissimum
1 reference
stated in
Constituents of the roots and stems of Aristolochia mollissima
Aristolochia mollissima
1 reference
stated in
Constituents of the roots and stems of Aristolochia mollissima
Aristolochia pubescens
1 reference
stated in
Diterpene esters of aristolochic acids from Aristolochia pubescens.
Identifiers
InChI
InChI=1S/C17H11NO8/c1-24-12-3-7(19)2-9-8(12)4-11(18(22)23)14-10(17(20)21)5-13-16(15(9)14)26-6-25-13/h2-5,19H,6H2,1H3,(H,20,21)
0 references
InChIKey
PADIFGYTAXNCRK-UHFFFAOYSA-N
0 references
CAS Registry Number
17413-38-6
0 references
PubChem CID
161218
1 reference
matched by identifier from
InChIKey
InChIKey
PADIFGYTAXNCRK-UHFFFAOYSA-N
ChEBI ID
194152
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C17H11NO8/c1-24-12-3-7(19)2-9-8(12)4-11(18(22)23)14-10(17(20)21)5-13-16(15(9)14)26-6-25-13/h2-5,19H,6H2,1H3,(H,20,21)
SureChEMBL ID
SCHEMBL26801941
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
PADIFGYTAXNCRK-UHFFFAOYSA-N
UniChem compound ID
598747
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40169766
1 reference
matched by identifier from
InChIKey
InChIKey
PADIFGYTAXNCRK-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID4092257
0 references
KNApSAcK ID
C00027125
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
PADIFGYTAXNCRK-UHFFFAOYSA-N
C00032766
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
PADIFGYTAXNCRK-UHFFFAOYSA-N
Probes And Drugs ID
PD125718
0 references
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