CHEBI:205909 - Ulbactin 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 Ulbactin G
ChEBI ID CHEBI:205909
Stars This entity has been manually annotated by a third party.
Submitter MetaboLights
Supplier Information ZINC000004097885
Download Molfile XML SDF
Formula C17H19N3O2S3
Net Charge 0
Average Mass 393.540
Monoisotopic Mass 393.06394
InChI InChI=1S/C17H19N3O2S3/c1-19-11-7-25-17(19)12-8-24-16(20(12)15(11)22)10-6-23-14(18-10)9-4-2-3-5-13(9)21/h2-5,10-12,16-17,21H,6-8H2,1H3/t10-,11+,12-,16+,17-/m1/s1
InChIKey KDVBIWXQJGCQHY-XTUVOZTNSA-N
SMILES S1C(=N[C@H](C1)[C@@H]2SC[C@H]3N2C(=O)[C@H]4N(C)[C@@H]3SC4)C5=C(O)C=CC=C5
Metabolite of Species Details
Brevibacillusspecies (NCBI:txid1882945) See: PubMed
ChEBI Ontology
Outgoing Ulbactin G (CHEBI:205909) has functional parent α-amino acid (CHEBI:33704)
Ulbactin G (CHEBI:205909) is a organonitrogen compound (CHEBI:35352)
Ulbactin G (CHEBI:205909) is a organooxygen compound (CHEBI:36963)
IUPAC Name
(1R,2R,5S,8R)-5-[(4R)-2-(2-hydroxyphenyl)-4,5-dihydro-1,3-thiazol-4-yl]-11-methyl-4,10-dithia-6,11-diazatricyclo[6.2.1.02,6]undecan-7-one
Manual Xref Database
78437305 ChemSpider
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