CHEBI:2270 - 7-Methoxypradimicinone II

Main ChEBI Ontology Automatic Xrefs Reactions Pathways Models
ChEBI Name 7-Methoxypradimicinone II
ChEBI ID CHEBI:2270
Stars This entity has been manually annotated by a third party.
Supplier Information
Download Molfile XML SDF
Formula C29H25NO12
Net Charge 0
Average Mass 579.509
Monoisotopic Mass 579.13768
InChI InChI=1S/C29H25NO12/c1-8-5-11-16(23(34)14(8)28(38)30-9(2)29(39)40)17-19(26(37)22(11)33)27(42-4)20-18(25(17)36)21(32)12-6-10(41-3)7-13(31)15(12)24(20)35/h5-7,9,22,26,31,33-34,36-37H,1-4H3,(H,30,38)(H,39,40)/t9?,22-,26-/m0/s1
InChIKey GRWBRZRHHYOYGA-ZCUHFZEISA-N
SMILES COc1cc(O)c2C(=O)c3c(OC)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
ChEBI Ontology
Outgoing 7-Methoxypradimicinone II (CHEBI:2270) is a p-quinones (CHEBI:25830)
7-Methoxypradimicinone II (CHEBI:2270) is a tetracenes (CHEBI:51270)
Synonym Source
7-Methoxypradimicinone II KEGG COMPOUND
Manual Xref Database
C06781 KEGG COMPOUND
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Last Modified
03 June 2016