EMBL-EBI | Chemical Biology | ChEBI

Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search

CHEBI:67810 - tallysomycin S10B

ChEBI IDCHEBI:67810
ChEBI Nametallysomycin S10B
Stars
DefinitionA natural product found in Streptoalloteichus hindustanus.
Last Modified22 September 2014
DownloadsMolfile
FormulaC59H91N19O26S2
Net Charge0
Average Mass1546.618
Monoisotopic Mass1545.58241
SMILES[H][C@@]1(OC(NC(=O)[C@@H](NC(=O)C[C@H](O)[C@@H](C)NC(=O)[C@@H](NC(=O)c2nc([C@H](CC(N)=O)NC[C@H](N)C(N)=O)nc(N)c2C)[C@@H](O[C@]2([H])O[C@@H](CO)[C@@H](O)[C@H](O)[C@@H]2O[C@@]2([H])O[C@H](CO)[C@@H](O)[C@H](OC(N)=O)[C@@H]2O)c2cncn2)[C@@H](C)O)C(O)c2nc(-c3nc(C(=O)NCCCCN)cs3)cs2)O[C@@H](C)[C@@H](N)[C@@H](O)[C@H]1O
InChIInChI=1S/C59H91N19O26S2/c1-18-33(75-48(77-46(18)64)23(9-30(62)83)69-11-22(61)47(65)92)50(94)76-35(43(24-12-67-17-70-24)101-58-45(39(88)36(85)28(13-79)100-58)102-57-41(90)44(103-59(66)97)37(86)29(14-80)99-57)52(96)71-19(2)27(82)10-31(84)74-34(20(3)81)51(95)78-53(104-56-40(89)38(87)32(63)21(4)98-56)42(91)55-73-26(16-106-55)54-72-25(15-105-54)49(93)68-8-6-5-7-60/h12,15-17,19-23,27-29,32,34-45,53,56-58,69,79-82,85-91H,5-11,13-14,60-61,63H2,1-4H3,(H2,62,83)(H2,65,92)(H2,66,97)(H,67,70)(H,68,93)(H,71,96)(H,74,84)(H,76,94)(H,78,95)(H2,64,75,77)/t19-,20-,21+,22+,23+,27+,28+,29-,32-,34+,35+,36-,37-,38-,39+,40-,41+,42?,43+,44+,45+,53?,56+,57-,58+/m1/s1
InChIKeyMCUABSGWIRKSSZ-IZQRLZLVSA-N
Species of MetaboliteComponentSourceComments
Streptoalloteichus hindustanus (ncbitaxon:2017)
- PubMed (21210656) Strain: E465-94
- PubMed (21210656) Strain: ATCC31158
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
Biological Role:
metabolite  Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.
ChEBI Ontology
Outgoing Relation(s)
tallysomycin S10B (CHEBI:67810) has role metabolite (CHEBI:25212)
tallysomycin S10B (CHEBI:67810) is a glycopeptide (CHEBI:24396)
Synonym  Source
Bleomycinamide, N(sup 1)-(4-aminobutyl)-13-((4-amino-4,6-dideoxy-alpha-L-talopyranosyl)oxy)-19-demethyl-12-hydroxy-ChEBI
Registry NumbersSources
CAS:76069-32-4ChemIDplus
Citations