CHEBI:223694 - Taichunin B

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ChEBI Name Taichunin B
ChEBI ID CHEBI:223694
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information
Download Molfile XML SDF
Formula C19H26O5
Net Charge 0
Average Mass 334.412
Monoisotopic Mass 334.17802
InChI InChI=1S/C19H26O5/c1-5-18(4)10-7-11-12(14(18)20)16(23)24-19(11)9-6-8-17(2,3)13(19)15(21)22/h5,13-14,20H,1,6-10H2,2-4H3,(H,21,22)/t13-,14-,18-,19+/m0/s1
InChIKey QQXHZJNYZQQVRZ-KODHJQJWSA-N
SMILES O=C1O[C@@]2([C@@H](C(=O)O)C(CCC2)(C)C)C3=C1[C@H](O)[C@](C=C)(C)CC3
Metabolite of Species Details
Aspergillus (NCBI:txid5052) See: PubMed
ChEBI Ontology
Outgoing Taichunin B (CHEBI:223694) is a 2-benzofurans (CHEBI:38831)
IUPAC Name
(1'S,3S,6R,7R)-6-ethenyl-7-hydroxy-2',2',6-trimethyl-1-oxospiro[5,7-dihydro-4H-2-benzouran-3,6'-cyclohexane]-1'-carboxylic acid