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CHEBI:74934 - tetracenomycin D3(1−)

ChEBI IDCHEBI:74934
ChEBI Nametetracenomycin D3(1−)
Stars
ASCII Nametetracenomycin D3(1-)
DefinitionA hydroxy monocarboxylic acid anion that is the conjugate base of tetracenomycin F1, obtained by deprotonation of the carboxy group.
Last Modified16 June 2014
SubmitterKAX
DownloadsMolfile
FormulaC20H11O8
Net Charge-1
Average Mass379.300
Monoisotopic Mass379.04594
SMILESCc1c(C(=O)[O-])c(O)cc2cc3c(c(O)c12)C(=O)c1c(O)cc(O)cc1C3=O
InChIInChI=1S/C20H12O8/c1-6-13-7(3-11(22)14(6)20(27)28)2-9-16(18(13)25)19(26)15-10(17(9)24)4-8(21)5-12(15)23/h2-5,21-23,25H,1H3,(H,27,28)/p-1
InChIKeyOXCNORDLEQIUCT-UHFFFAOYSA-M
ChEBI Ontology
Outgoing Relation(s)
tetracenomycin D3(1−) (CHEBI:74934) is a hydroxy monocarboxylic acid anion (CHEBI:36059)
tetracenomycin D3(1−) (CHEBI:74934) is conjugate acid of tetracenomycin D3(2−) (CHEBI:77990)
tetracenomycin D3(1−) (CHEBI:74934) is conjugate base of tetracenomycin D3 (CHEBI:32202)
Incoming Relation(s)
tetracenomycin D3 (CHEBI:32202) is conjugate acid of tetracenomycin D3(1−) (CHEBI:74934)
tetracenomycin D3(2−) (CHEBI:77990) is conjugate base of tetracenomycin D3(1−) (CHEBI:74934)
IUPAC Name 
3,8,10,12-tetrahydroxy-1-methyl-6,11-dioxo-6,11-dihydrotetracene-2-carboxylate