CHEBI:222494 - Gilvocarcin E

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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 Gilvocarcin E
ChEBI ID CHEBI:222494
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/c1-5-12-8-15-19(17(9-12)33-3)14-10-18(34-4)21-16(29)7-6-13(20(21)25(14)36-27(15)32)26-23(31)22(30)24(35-26)11(2)28/h6-11,22-24,26,28-31H,5H2,1-4H3/t11-,22-,23-,24+,26-/m1/s1
InChIKey MHEQKYHSXMKYKF-UCDARZNSSA-N
SMILES O=C1OC=2C=3C(C(OC)=CC2C4=C1C=C(CC)C=C4OC)=C(O)C=CC3[C@H]5O[C@@H]([C@H](O)C)[C@@H]([C@H]5O)O
Metabolite of Species Details
Streptomyces anandii (NCBI:txid285454) See: PubMed
ChEBI Ontology
Outgoing Gilvocarcin E (CHEBI:222494) is a glycoside (CHEBI:24400)
IUPAC Name
4-[(2R,3R,4R,5S)-3,4-dihydroxy-5-[(1R)-1-hydroxyethyl]oxolan-2-yl]-8-ethyl-1-hydroxy-10,12-dimethoxynaphtho[1,2-c]isochromen-6-one
Manual Xref Database
117824 ChemSpider
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