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CHEBI:213285 - Victorinine D

ChEBI IDCHEBI:213285
ChEBI NameVictorinine D
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC31H46Cl3N7O10
Net Charge0
Average Mass783.107
Monoisotopic Mass781.23717
SMILESCC(C[C@H](NC(=O)CN)C(=O)N[C@H](C(=O)N[C@@H]1C(=O)N/C(=C/Cl)C(=O)N[C@H](C(=O)O)CC2=C(CCC2=O)O[C@H]1C(C)C)[C@H](O)CCCN)C(Cl)Cl
InChIInChI=1S/C31H46Cl3N7O10/c1-13(2)25-24(30(48)39-18(11-32)28(46)38-17(31(49)50)10-15-19(42)6-7-21(15)51-25)41-29(47)23(20(43)5-4-8-35)40-27(45)16(37-22(44)12-36)9-14(3)26(33)34/h11,13-14,16-17,20,23-26,43H,4-10,12,35-36H2,1-3H3,(H,37,44)(H,38,46)(H,39,48)(H,40,45)(H,41,47)(H,49,50)/b18-11+/t14?,16-,17-,20+,23-,24-,25-/m0/s1
InChIKeyJNYDADOEVOGHEM-RSMAXFQVSA-N
Species of MetaboliteComponentSourceComments
Bipolaris victoriae (ncbitaxon:40125) - PubMed (32929037)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Victorinine D (CHEBI:213285) is a polypeptide (CHEBI:15841)
IUPAC Name 
(3S,4S,7E,10S)-4-[[(2S,3R)-6-amino-2-[[(2S)-2-[(2-aminoacetyl)amino]-5,5-dichloro-4-methylpentanoyl]amino]-3-hydroxyhexanoyl]amino]-7-(chloromethylidene)-5,8,13-trioxo-3-propan-2-yl-2-oxa-6,9-diazabicyclo[10.3.0]pentadec-1(12)-ene-10-carboxylic acid