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CHEBI:211872 - Jadomycin T

ChEBI IDCHEBI:211872
ChEBI NameJadomycin T
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SubmitterMetaboLights
DownloadsMolfile
FormulaC28H27NO10
Net Charge0
Average Mass537.521
Monoisotopic Mass537.16350
SMILESCc1cc(O)c2c(c1)[C@@H]1OC(=O)[C@H]([C@@H](C)O)N1C1=C2C(=O)c2cccc(O[C@H]3C[C@@H](O)[C@@H](O)[C@H](C)O3)c2C1=O
InChIInChI=1S/C28H27NO10/c1-10-7-14-19(15(31)8-10)21-23(29-22(11(2)30)28(36)39-27(14)29)26(35)20-13(25(21)34)5-4-6-17(20)38-18-9-16(32)24(33)12(3)37-18/h4-8,11-12,16,18,22,24,27,30-33H,9H2,1-3H3/t11-,12+,16-,18+,22+,24+,27+/m1/s1
InChIKeyMJZNHFLLLVVUBU-KUBCBTNXSA-N
Species of MetaboliteComponentSourceComments
Streptomyces venezuelae ATCC 10712 (ncbitaxon:953739) - PubMed (15070349)
ChEBI Ontology
Outgoing Relation(s)
Jadomycin T (CHEBI:211872) is a phenanthridines (CHEBI:51245)
IUPAC Name 
(3S,6S)-19-[(2S,4R,5R,6S)-4,5-dihydroxy-6-methyloxan-2-yl]oxy-11-hydroxy-3-[(1R)-1-hydroxyethyl]-9-methyl-5-oxa-2-azapentacyclo[11.8.0.02,6.07,12.015,20]henicosa-1(13),7(12),8,10,15(20),16,18-heptaene-4,14,21-trione
Manual XrefsDatabases
78438534ChemSpider