Trichovirin II 2b (CHEBI:208591)

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CHEBI:208591 - Trichovirin II 2b

ChEBI ID	CHEBI:208591
ChEBI Name	Trichovirin II 2b
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C79H138N20O21
Net Charge	0
Average Mass	1704.092
Monoisotopic Mass	1703.03454
SMILES	CC(=O)NC(C)(C)C(=O)NCC(=O)NC(C)C(=O)NC(CC(C)C)C(=O)NC(C)(C)C(=O)NC(CCC(N)=O)C(=O)NC(C)(C)C(=O)NC(C(=O)NC(C)(C)C(=O)NCC(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)N1CCCC1C(=O)NC(CC(C)C)C(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NC(CCC(N)=O)C(=O)NC(CO)CC(C)C)C(C)C
InChI	InChI=1S/C79H138N20O21/c1-40(2)34-46(39-100)85-58(107)47(29-31-52(80)102)88-67(116)76(19,20)97-70(119)78(23,24)95-61(110)50(36-42(5)6)87-62(111)51-28-27-33-99(51)71(120)79(25,26)98-69(118)77(21,22)92-55(105)38-83-65(114)73(13,14)96-63(112)56(43(7)8)90-68(117)75(17,18)93-59(108)48(30-32-53(81)103)89-66(115)74(15,16)94-60(109)49(35-41(3)4)86-57(106)44(9)84-54(104)37-82-64(113)72(11,12)91-45(10)101/h40-44,46-51,56,100H,27-39H2,1-26H3,(H2,80,102)(H2,81,103)(H,82,113)(H,83,114)(H,84,104)(H,85,107)(H,86,106)(H,87,111)(H,88,116)(H,89,115)(H,90,117)(H,91,101)(H,92,105)(H,93,108)(H,94,109)(H,95,110)(H,96,112)(H,97,119)(H,98,118)
InChIKey	LFBFYBMMVFSJDE-UHFFFAOYSA-N

Species of Metabolite	Component	Source	Comments
Trichoderma (ncbitaxon:5543)	-	PubMed (10507683)

Roles Classification

Chemical Role:

Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid).

ChEBI Ontology

Outgoing Relation(s)
	Trichovirin II 2b (CHEBI:208591) is a polypeptide (CHEBI:15841)

IUPAC Name
2-[[2-[[2-[[2-[[1-[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[2-[[2-[(2-acetamido-2-methylpropanoyl)amino]acetyl]amino]propanoylamino]-4-methylpentanoyl]amino]-2-methylpropanoyl]amino]-5-amino-5-oxopentanoyl]amino]-2-methylpropanoyl]amino]-3-methylbutanoyl]amino]-2-methylpropanoyl]amino]acetyl]amino]-2-methylpropanoyl]amino]-2-methylpropanoyl]pyrrolidine-2-carbonyl]amino]-4-methylpentanoyl]amino]-2-methylpropanoyl]amino]-2-methylpropanoyl]amino]-N-(1-hydroxy-4-methylpentan-2-yl)pentanediamide

IUPAC Name

2-[[2-[[2-[[2-[[1-[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[[2-[2-[[2-[(2-acetamido-2-methylpropanoyl)amino]acetyl]amino]propanoylamino]-4-methylpentanoyl]amino]-2-methylpropanoyl]amino]-5-amino-5-oxopentanoyl]amino]-2-methylpropanoyl]amino]-3-methylbutanoyl]amino]-2-methylpropanoyl]amino]acetyl]amino]-2-methylpropanoyl]amino]-2-methylpropanoyl]pyrrolidine-2-carbonyl]amino]-4-methylpentanoyl]amino]-2-methylpropanoyl]amino]-2-methylpropanoyl]amino]-N-(1-hydroxy-4-methylpentan-2-yl)pentanediamide

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78444847	ChemSpider