CHEBI:218376 - Chrysomycin B

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This entity has been annotated by a third party. If you would like more information added to this entry, please contact ChEBI via email or GitHub.
ChEBI Name Chrysomycin B
ChEBI ID CHEBI:218376
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C27H28O9
Net Charge 0
Average Mass 496.512
Monoisotopic Mass 496.17333
InChI InChI=1S/C27H28O9/c1-11-8-15-19(17(9-11)33-4)14-10-18(34-5)21-16(28)7-6-13(20(21)22(14)36-26(15)31)23-25(30)27(3,32)24(29)12(2)35-23/h6-10,12,23-25,28-30,32H,1-5H3/t12-,23+,24+,25+,27-/m1/s1
InChIKey BJPYMDSMDBCKEP-QSMCFSHASA-N
SMILES O=C1OC=2C=3C(C(OC)=CC2C4=C1C=C(C)C=C4OC)=C(O)C=CC3[C@@H]5O[C@@H]([C@H](O)[C@]([C@H]5O)(O)C)C
Metabolite of Species Details
Streptomyces (NCBI:txid1883) See: PubMed
ChEBI Ontology
Outgoing Chrysomycin B (CHEBI:218376) is a glycoside (CHEBI:24400)
IUPAC Name
1-hydroxy-10,12-dimethoxy-8-methyl-4-[(2S,3S,4R,5S,6R)-3,4,5-trihydroxy-4,6-dimethyloxan-2-yl]naphtho[1,2-c]isochromen-6-one
Manual Xref Database
17346493 ChemSpider
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