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(Q104399506)
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Artonin B
group of stereoisomers with the chemical formula C₃₀H₃₀O₇
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Statements
instance of
group of stereoisomers
0 references
subclass of
5,6-dihydrobenzo[c]xanthen-7-one flavonoid
1 reference
inferred from
5,6-dihydrobenzo[c]xanthen-7-one flavonoid
mass
502.1991533
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₀H₃₀O₇
0 references
canonical SMILES
O=C1C2=C(O)C=3C=CC(OC3C(=C2OC=4C=5C(O)=CC(O)=C(O)C5C(C(=C)C)CC14)CC=C(C)C)(C)C
0 references
found in taxon
Artocarpus heterophyllus
1 reference
stated in
Prenylated flavonoids and related compounds of the Indonesian Artocarpus (Moraceae)
Artocarpus integer
2 references
stated in
Artonins A and B, Two New Prenylflavonoes from the Root Bark of Artocarpus heterophyllus Lamk
stated in
Prenylflavonoids of Artocarpus heterophyllus
Identifiers
InChI
InChI=1S/C30H30O7/c1-13(2)7-8-16-27-15(9-10-30(5,6)37-27)24(33)23-25(34)18-11-17(14(3)4)21-22(29(18)36-28(16)23)19(31)12-20(32)26(21)35/h7,9-10,12,17,31-33,35H,3,8,11H2,1-2,4-6H3
0 references
InChIKey
IGNKZOMBJGAKHN-UHFFFAOYSA-N
0 references
CAS Registry Number
136657-54-0
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
124693-70-5
1 reference
stated in
CAS (formerly Chemical Abstracts Service)
retrieved
25 January 2022
PubChem CID
11964501
1 reference
stated in
PubChem
retrieved
26 December 2021
inferred from
InChIKey
ChEBI ID
175846
mapping relation type
exact match
2 references
stated in
ChEBI release 2022-06-13
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C30H30O7/c1-13(2)7-8-16-27-15(9-10-30(5,6)37-27)24(33)23-25(34)18-11-17(14(3)4)21-22(29(18)36-28(16)23)19(31)12-20(32)26(21)35/h7,9-10,12,17,31-33,35H,3,8,11H2,1-2,4-6H3
SureChEMBL ID
SCHEMBL21065402
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
IGNKZOMBJGAKHN-UHFFFAOYSA-N
UniChem compound ID
395482
1 reference
stated in
UniChem
Human Metabolome Database ID
HMDB0034667
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
IGNKZOMBJGAKHN-UHFFFAOYSA-N
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