EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:210025 - Radamycin

ChEBI IDCHEBI:210025
ChEBI NameRadamycin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC48H47N15O11S3
Net Charge0
Average Mass1106.199
Monoisotopic Mass1105.27416
SMILESC=C(NC(=O)C(=C)NC(=O)c1ccc2c(n1)-c1nc(oc1C)C(=C)NC(=O)C(=C)NC(=O)c1csc(n1)C(C)NC(=O)c1csc(n1)C(C)NC(=O)c1nc(oc1C)CNC(=O)C(C(C)C)NC(=O)c1csc-2n1)C(N)=O
InChIInChI=1S/C48H47N15O11S3/c1-17(2)32-43(71)50-13-31-61-34(25(10)73-31)44(72)56-23(8)47-59-29(15-76-47)41(69)55-22(7)46-58-28(14-75-46)40(68)53-20(5)38(66)54-21(6)45-63-33(24(9)74-45)35-26(48-60-30(16-77-48)42(70)62-32)11-12-27(57-35)39(67)52-19(4)37(65)51-18(3)36(49)64/h11-12,14-17,22-23,32H,3-6,13H2,1-2,7-10H3,(H2,49,64)(H,50,71)(H,51,65)(H,52,67)(H,53,68)(H,54,66)(H,55,69)(H,56,72)(H,62,70)
InChIKeyNDNYFEHDYFDAPS-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Streptomyces (ncbitaxon:1883) - PubMed (12061546)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Radamycin (CHEBI:210025) is a peptide (CHEBI:16670)
IUPAC Name 
N-[3-[(3-amino-3-oxoprop-1-en-2-yl)amino]-3-oxoprop-1-en-2-yl]-20,24,31,44-tetramethyl-38,41-dimethylidene-12,15,22,29,36,39-hexaoxo-14-propan-2-yl-19,43-dioxa-9,26,33-trithia-3,13,16,23,30,37,40,45,46,47,48,49-dodecazaheptacyclo[40.2.1.18,11.118,21.125,28.132,35.02,7]nonatetraconta-1(44),2(7),3,5,8(49),10,18(48),20,25(47),27,32(46),34,42(45)-tridecaene-4-carboxamide
Manual XrefsDatabases
17298437ChemSpider