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CHEBI:223752 - Holrhizin P

ChEBI IDCHEBI:223752
ChEBI NameHolrhizin P
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC40H64N6O10
Net Charge0
Average Mass788.984
Monoisotopic Mass788.46839
SMILESCCCCCC(=O)N[C@H](C(=O)N[C@@H](Cc1ccccc1)C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(C)C)C(=O)O)C(C)C
InChIInChI=1S/C40H64N6O10/c1-9-10-12-17-32(47)46-34(25(6)7)39(54)44-30(22-27-15-13-11-14-16-27)38(53)42-28(18-19-33(48)49)36(51)43-29(20-23(2)3)37(52)41-26(8)35(50)45-31(40(55)56)21-24(4)5/h11,13-16,23-26,28-31,34H,9-10,12,17-22H2,1-8H3,(H,41,52)(H,42,53)(H,43,51)(H,44,54)(H,45,50)(H,46,47)(H,48,49)(H,55,56)/t26-,28-,29-,30-,31-,34-/m0/s1
InChIKeyLCCLYJHYSYPDBN-HLMVIKOSSA-N
Species of MetaboliteComponentSourceComments
Mycetohabitans rhizoxinica (ncbitaxon:412963) - PubMed (32031805)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Holrhizin P (CHEBI:223752) is a polypeptide (CHEBI:15841)
IUPAC Name 
(2S)-2-[[(2S)-2-[[(2S)-2-[[(2S)-4-carboxy-2-[[(2S)-2-[[(2S)-2-(hexanoylamino)-3-methylbutanoyl]amino]-3-phenylpropanoyl]amino]butanoyl]amino]-4-methylpentanoyl]amino]propanoyl]amino]-4-methylpentanoic acid