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CHEBI:201305 - Roseoferin C1

ChEBI IDCHEBI:201305
ChEBI NameRoseoferin C1
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC60H110N10O12
Net Charge0
Average Mass1163.598
Monoisotopic Mass1162.83047
SMILESCCCCCCCCC(C)C(=O)N1CCCC1C(=O)NC(CC(C)CC(O)CC(=O)CC)C(=O)NC(C)C(=O)NC(C)(C)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
InChIInChI=1S/C60H110N10O12/c1-18-22-23-24-25-26-28-40(8)54(79)70-30-27-29-46(70)51(76)63-45(34-37(5)33-44(73)35-43(72)21-4)50(75)62-42(10)49(74)66-58(11,12)56(81)65-47(38(6)19-2)52(77)64-48(39(7)20-3)53(78)67-60(15,16)57(82)68-59(13,14)55(80)61-41(9)36-69(17)31-32-71/h37-42,44-48,71,73H,18-36H2,1-17H3,(H,61,80)(H,62,75)(H,63,76)(H,64,77)(H,65,81)(H,66,74)(H,67,78)(H,68,82)
InChIKeyXDAMKOHVQYAWCP-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 C1 (CHEBI:201305) 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]-2-methyl-1-oxopropan-2-yl]amino]-1-oxopropan-2-yl]amino]-4-methyl-1,8-dioxodecan-2-yl]-1-(2-methyldecanoyl)pyrrolidine-2-carboxamide
Manual XrefsDatabases
78444779ChemSpider