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CHEBI:200312 - Tetroazolemycin B

ChEBI IDCHEBI:200312
ChEBI NameTetroazolemycin B
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SubmitterMetaboLights
DownloadsMolfile
FormulaC34H40N6O6S4
Net Charge0
Average Mass756.998
Monoisotopic Mass756.18922
SMILESCN1[C@@H](CN2C(=O)[C@H]3CSSC[C@@H]2C(=O)N3C[C@H]2CS[C@@H]([C@@H]3COC(c4ccccc4O)=N3)N2C)CS[C@@H]1[C@@H]1COC(c2ccccc2O)=N1
InChIInChI=1S/C34H40N6O6S4/c1-37-19(15-47-33(37)23-13-45-29(35-23)21-7-3-5-9-27(21)41)11-39-25-17-49-50-18-26(31(39)43)40(32(25)44)12-20-16-48-34(38(20)2)24-14-46-30(36-24)22-8-4-6-10-28(22)42/h3-10,19-20,23-26,33-34,41-42H,11-18H2,1-2H3/t19-,20-,23-,24-,25+,26+,33-,34+/m0/s1
InChIKeyPLNJNPILMFLHRV-NDEUFGCJSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (23665958)
ChEBI Ontology
Outgoing Relation(s)
Tetroazolemycin B (CHEBI:200312) has functional parent α-amino acid (CHEBI:33704)
Tetroazolemycin B (CHEBI:200312) is a organonitrogen compound (CHEBI:35352)
Tetroazolemycin B (CHEBI:200312) is a organooxygen compound (CHEBI:36963)
IUPAC Name 
(1S,6S)-9-[[(2S,4S)-2-[(4S)-2-(2-hydroxyphenyl)-4,5-dihydro-1,3-oxazol-4-yl]-3-methyl-1,3-thiazolidin-4-yl]methyl]-7-[[(2R,4S)-2-[(4S)-2-(2-hydroxyphenyl)-4,5-dihydro-1,3-oxazol-4-yl]-3-methyl-1,3-thiazolidin-4-yl]methyl]-3,4-dithia-7,9-diazabicyclo[4.2.2]decane-8,10-dione
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78436603ChemSpider