EMBL-EBI | Chemical Biology | ChEBI

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

CHEBI:198159 - Roseoferin G

ChEBI IDCHEBI:198159
ChEBI NameRoseoferin G
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC61H112N10O12
Net Charge0
Average Mass1177.625
Monoisotopic Mass1176.84612
SMILESCCCCCCCCC(C)C(=O)N1CCCC1C(=O)NC(CC(C)CC(O)CC(=O)CC)C(=O)NC(C)C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NC(C)CN(C)CCO)C(C)CC)C(C)CC)C(C)C
InChIInChI=1S/C61H112N10O12/c1-18-22-23-24-25-26-28-41(10)57(81)71-30-27-29-47(71)53(77)64-46(34-38(7)33-45(74)35-44(73)21-4)52(76)63-43(12)51(75)65-48(37(5)6)54(78)66-49(39(8)19-2)55(79)67-50(40(9)20-3)56(80)68-61(15,16)59(83)69-60(13,14)58(82)62-42(11)36-70(17)31-32-72/h37-43,45-50,72,74H,18-36H2,1-17H3,(H,62,82)(H,63,76)(H,64,77)(H,65,75)(H,66,78)(H,67,79)(H,68,80)(H,69,83)
InChIKeyXLIXDHZWFVRVQH-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Mycogone rosea (ncbitaxon:129585) - PubMed (10805580)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Roseoferin G (CHEBI:198159) is a oligopeptide (CHEBI:25676)
IUPAC Name 
N-[6-hydroxy-1-[[1-[[1-[[1-[[1-[[1-[[1-[1-[2-hydroxyethyl(methyl)amino]propan-2-ylamino]-2-methyl-1-oxopropan-2-yl]amino]-2-methyl-1-oxopropan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-4-methyl-1,8-dioxodecan-2-yl]-1-(2-methyldecanoyl)pyrrolidine-2-carboxamide
Manual XrefsDatabases
78444750ChemSpider