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(Q105140497)
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English
Coriandrone C
chemical compound
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Statements
instance of
type of chemical entity
0 references
subclass of
chemical compound
0 references
mass
246.05282342
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₁₃H₁₀O₅
0 references
canonical SMILES
O=C1OC(=CC=2C=C3OC=CC3=C(OC)C12)CO
0 references
found in taxon
Coriandrum sativum
3 references
stated in
Three isocoumarins from Coriandrum sativum
stated in
Three isocoumarins from Coriandrum sativum
stated in
Coriandrin, a novel highly photoactive compound isolated from Coriandrum sativum
Identifiers
InChI
InChI=1S/C13H10O5/c1-16-12-9-2-3-17-10(9)5-7-4-8(6-14)18-13(15)11(7)12/h2-5,14H,6H2,1H3
0 references
InChIKey
KFOFBVHBCDBMPK-UHFFFAOYSA-N
0 references
CAS Registry Number
177795-32-3
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
101995280
2 references
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
matched by identifier from
InChIKey
InChIKey
KFOFBVHBCDBMPK-UHFFFAOYSA-N
ChEBI ID
174270
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C13H10O5/c1-16-12-9-2-3-17-10(9)5-7-4-8(6-14)18-13(15)11(7)12/h2-5,14H,6H2,1H3
UniChem compound ID
32009656
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID801181449
1 reference
matched by identifier from
InChIKey
InChIKey
KFOFBVHBCDBMPK-UHFFFAOYSA-N
Human Metabolome Database ID
HMDB0041525
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
KFOFBVHBCDBMPK-UHFFFAOYSA-N
KNApSAcK ID
C00054279
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
KFOFBVHBCDBMPK-UHFFFAOYSA-N
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