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CHEBI:199848 - Halovir D

ChEBI IDCHEBI:199848
ChEBI NameHalovir D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC43H79N7O9
Net Charge0
Average Mass838.145
Monoisotopic Mass837.59393
SMILESCCCCCCCCCCCC(=O)NC(C)(C)C(=O)N1C[C@@H](O)C[C@H]1C(=O)NC(CC(C)C)C(=O)N[C@H](C(=O)NC(CCC(N)=O)C(=O)N[C@H](CO)CC(C)C)C(C)C
InChIInChI=1S/C43H79N7O9/c1-10-11-12-13-14-15-16-17-18-19-36(54)49-43(8,9)42(59)50-25-31(52)24-34(50)40(57)47-33(23-28(4)5)39(56)48-37(29(6)7)41(58)46-32(20-21-35(44)53)38(55)45-30(26-51)22-27(2)3/h27-34,37,51-52H,10-26H2,1-9H3,(H2,44,53)(H,45,55)(H,46,58)(H,47,57)(H,48,56)(H,49,54)/t30-,31-,32?,33?,34-,37-/m0/s1
InChIKeyXLHSKXDZYNSELH-NUNUOSAZSA-N
Species of MetaboliteComponentSourceComments
Scytalidiumspecies (ncbitaxon:1715249) - PubMed (12951157)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Halovir D (CHEBI:199848) is a oligopeptide (CHEBI:25676)
IUPAC Name 
2-[[(2S)-2-[[2-[[(2S,4S)-1-[2-(dodecanoylamino)-2-methylpropanoyl]-4-hydroxypyrrolidine-2-carbonyl]amino]-4-methylpentanoyl]amino]-3-methylbutanoyl]amino]-N-[(2S)-1-hydroxy-4-methylpentan-2-yl]pentanediamide
Manual XrefsDatabases
10479907ChemSpider