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(Q82904976)
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English
1H-Cyclohept(ghi)perylene-6,11-dione, 3-acetyl-5,12-dihydroxy-4,8,9,13-tetramethoxy-2-methyl-, (+-)-
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
chemical compound
0 references
mass
530.157682412
dalton
1 reference
based on heuristic
inferred from SMILES
chemical formula
C₃₀H₂₆O₉
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canonical SMILES
O=C(C1=C(OC)C(O)=C2C=3C(=O)CC(OC)=C4C(OC)=CC=5C(=O)C(O)C(OC)=C6C(C5C34)=C2C1=C(C)C6)C
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found in taxon
Shiraia bambusicola
1 reference
stated in
New Perylenequinones fromShiraia bambusicola
Identifiers
InChI
InChI=1S/C30H26O9/c1-10-7-13-20-19-12(26(33)28(35)29(13)38-5)8-15(36-3)22-16(37-4)9-14(32)21(24(19)22)25-23(20)17(10)18(11(2)31)30(39-6)27(25)34/h8,28,34-35H,7,9H2,1-6H3
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InChIKey
SWPTZKGTJRUNTL-UHFFFAOYSA-N
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CAS Registry Number
137592-26-8
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PubChem CID
132083
2 references
stated in
PubChem
retrieved
17 September 2022
based on heuristic
inferred from InChIKey
matched by identifier from
InChIKey
InChIKey
SWPTZKGTJRUNTL-UHFFFAOYSA-N
UniChem compound ID
67285622
1 reference
stated in
UniChem
DSSTox substance ID
DTXSID40929847
1 reference
matched by identifier from
InChIKey
InChIKey
SWPTZKGTJRUNTL-UHFFFAOYSA-N
DSSTOX compound identifier
DTXCID301358588
0 references
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