CHEBI:8353 - Pradimicinone II

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ChEBI Name Pradimicinone II
ChEBI ID CHEBI:8353
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C28H23NO12
Net Charge 0
Average Mass 565.483
Monoisotopic Mass 565.12203
InChI InChI=1S/C28H23NO12/c1-7-4-10-15(22(33)13(7)27(38)29-8(2)28(39)40)16-17(26(37)21(10)32)25(36)19-18(24(16)35)20(31)11-5-9(41-3)6-12(30)14(11)23(19)34/h4-6,8,21,26,30,32-33,35-37H,1-3H3,(H,29,38)(H,39,40)/t8?,21-,26-/m0/s1
InChIKey SBIJXMUETDVEQB-CJERNAKNSA-N
SMILES COc1cc(O)c2C(=O)c3c(O)c4[C@H](O)[C@@H](O)c5cc(C)c(C(=O)NC(C)C(O)=O)c(O)c5-c4c(O)c3C(=O)c2c1
Roles Classification
Chemical Role(s): Bronsted acid
A molecular entity capable of donating a hydron to an acceptor (Bronsted base).
(via oxoacid )
View more via ChEBI Ontology
ChEBI Ontology
Outgoing Pradimicinone II (CHEBI:8353) is a p-quinones (CHEBI:25830)
Pradimicinone II (CHEBI:8353) is a carboxylic acid (CHEBI:33575)
Pradimicinone II (CHEBI:8353) is a tetracenes (CHEBI:51270)
Synonym Source
Pradimicinone II KEGG COMPOUND
Manual Xrefs Databases
C00016804 KNApSAcK
C06780 KEGG COMPOUND
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Last Modified
06 June 2016