CHEBI:200948 - Nitrosporeunol G

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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 Nitrosporeunol G
ChEBI ID CHEBI:200948
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C22H32O3
Net Charge 0
Average Mass 344.495
Monoisotopic Mass 344.23514
InChI InChI=1S/C22H32O3/c1-13-7-8-16-20(3,4)9-6-10-21(16,5)15(13)12-22-17(23)11-14(2)18(24)19(22)25-22/h11,15-16,18-19,24H,1,6-10,12H2,2-5H3/t15-,16-,18-,19-,21+,22+/m1/s1
InChIKey KNKNDFJJDANQJU-AHFIBXSNSA-N
SMILES O=C1C=C([C@@H](O)[C@@H]2[C@]1(O2)C[C@@H]3C(=C)CC[C@H]4[C@]3(CCCC4(C)C)C)C
Metabolite of Species Details
Streptomyces (NCBI:txid1883) See: PubMed
ChEBI Ontology
Outgoing Nitrosporeunol G (CHEBI:200948) is a cyclohexenones (CHEBI:48953)
IUPAC Name
(1R,5R,6R)-1-[[(1R,4aR,8aR)-5,5,8a-trimethyl-2-methylidene-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]methyl]-5-hydroxy-4-methyl-7-oxabicyclo[4.1.0]hept-3-en-2-one
Manual Xref Database
34981222 ChemSpider
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