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(Q104193177)
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English
2,5-dihydroxy-3,6-bis[[2-(3-methylbut-2-enyl)-1H-indol-3-yl]methyl]cyclohexa-2,5-diene-1,4-dione
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
indole alkaloid
0 references
mass
534.251857568
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₄H₃₄N₂O₄
0 references
canonical SMILES
O=C1C(O)=C(C(=O)C(O)=C1CC=2C=3C=CC=CC3NC2CC=C(C)C)CC=4C=5C=CC=CC5NC4CC=C(C)C
0 references
found in taxon
Aspergillus candidus
1 reference
stated in
Asterriquinones produced by Aspergillus candidus inhibit binding of the Grb-2 adapter to phosphorylated EGF receptor tyrosine kinase.
Identifiers
InChI
InChI=1S/C34H34N2O4/c1-19(2)13-15-29-23(21-9-5-7-11-27(21)35-29)17-25-31(37)33(39)26(34(40)32(25)38)18-24-22-10-6-8-12-28(22)36-30(24)16-14-20(3)4/h5-14,35-37,40H,15-18H2,1-4H3
0 references
InChIKey
OAESCRDRJBFQOR-UHFFFAOYSA-N
0 references
PubChem CID
10482249
1 reference
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
ChEBI ID
222361
mapping relation type
exact match
1 reference
matched by identifier from
International Chemical Identifier
InChI
InChI=1S/C34H34N2O4/c1-19(2)13-15-29-23(21-9-5-7-11-27(21)35-29)17-25-31(37)33(39)26(34(40)32(25)38)18-24-22-10-6-8-12-28(22)36-30(24)16-14-20(3)4/h5-14,35-37,40H,15-18H2,1-4H3
UniChem compound ID
34471344
1 reference
stated in
UniChem
Natural Product Atlas ID
NPA016400
2 references
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
OAESCRDRJBFQOR-UHFFFAOYSA-N
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