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CHEBI:227484 - Botryosulfuranol B

ChEBI IDCHEBI:227484
ChEBI NameBotryosulfuranol B
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC21H24N2O6S2
Net Charge0
Average Mass464.565
Monoisotopic Mass464.10758
SMILESCS[C@H]1c2ccccc2O[C@@]12C(=O)N1O[C@@]3(CCCCC3=O)[C@H](O)[C@]1(SC)C(=O)N2C
InChIInChI=1S/C21H24N2O6S2/c1-22-18(27)21(31-3)16(25)19(11-7-6-10-14(19)24)29-23(21)17(26)20(22)15(30-2)12-8-4-5-9-13(12)28-20/h4-5,8-9,15-16,25H,6-7,10-11H2,1-3H3/t15-,16-,19+,20+,21-/m0/s1
InChIKeyFFUFIKVVLJPVQD-KHDMTIDOSA-N
Species of MetaboliteComponentSourceComments
Cophinforma mamane (ncbitaxon:144557) - PubMed (30576967)
ChEBI Ontology
Outgoing Relation(s)
Botryosulfuranol B (CHEBI:227484) has functional parent α-amino acid (CHEBI:33704)
Botryosulfuranol B (CHEBI:227484) is a organonitrogen compound (CHEBI:35352)
Botryosulfuranol B (CHEBI:227484) is a organooxygen compound (CHEBI:36963)