CHEBI:226710 - Olivoretin A

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ChEBI Name Olivoretin A
ChEBI ID CHEBI:226710
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C29H43N3O2
Net Charge 0
Average Mass 465.682
Monoisotopic Mass 465.33553
InChI InChI=1S/C29H43N3O2/c1-10-28(6)11-12-29(7,18(4)5)21-14-22-23-19(15-30-25(23)24(21)28)13-20(16-34-9)31-27(33)26(17(2)3)32(22)8/h10,14-15,17-18,20,26,30H,1,11-13,16H2,2-9H3,(H,31,33)/t20-,26-,28-,29+/m0/s1
InChIKey HQINLFPKZPQGGD-ZVYOULDASA-N
SMILES O=C1N[C@@H](CC2=CNC=3C2=C(N([C@H]1C(C)C)C)C=C4[C@@](C(C)C)(CC[C@@](C34)(C=C)C)C)COC
Metabolite of Species Details
Streptomyces olivoreticuli (NCBI:txid68246) See: DOI
ChEBI Ontology
Outgoing Olivoretin A (CHEBI:226710) is a amino acid amide (CHEBI:22475)
IUPAC Name
(6S,9S,14R,17R)-17-ethenyl-6-(methoxymethyl)-10,14,17-trimethyl-9,14-di(propan-2-yl)-2,7,10-triazatetracyclo[9.7.1.04,19.013,18]nonadeca-1(18),3,11(19),12-tetraen-8-one
Manual Xref Database
128918 ChemSpider
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