CHEBI:4726 - Dynemicin A

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ChEBI Name Dynemicin A
ChEBI ID CHEBI:4726
Stars This entity has been manually annotated by a third party.
Supplier Information
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Formula C30H19NO9
Net Charge 0
Average Mass 537.474
Monoisotopic Mass 537.10598
InChI InChI=1S/C30H19NO9/c1-12-19(28(37)38)27(39-2)13-7-5-3-4-6-8-18-29(12)30(13,40-29)14-11-17(34)22-23(24(14)31-18)26(36)21-16(33)10-9-15(32)20(21)25(22)35/h3-4,9-13,18,31-34H,1-2H3,(H,37,38)/b4-3-/t12-,13-,18?,29-,30+/m0/s1
InChIKey AFMYMMXSQGUCBK-CWSCUYGGSA-N
SMILES COC1=C([C@H](C)[C@@]23O[C@@]22[C@H]1C#C\C=C/C#CC3Nc1c2cc(O)c2C(=O)c3c(O)ccc(O)c3C(=O)c12)C(O)=O
ChEBI Ontology
Outgoing Dynemicin A (CHEBI:4726) is a anthraquinone (CHEBI:22580)
Synonym Source
Dynemicin A KEGG COMPOUND
Manual Xrefs Databases
C00017528 KNApSAcK
C11471 KEGG COMPOUND
View more database links
Registry Number Type Source
124412-57-3 CAS Registry Number KEGG COMPOUND
Last Modified
28 July 2014