Trichorzin HA-5 (CHEBI:220852)

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CHEBI:220852 - Trichorzin HA-5

ChEBI ID	CHEBI:220852
ChEBI Name	Trichorzin HA-5
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C81H142N20O21
Net Charge	0
Average Mass	1732.146
Monoisotopic Mass	1731.06584
SMILES	CCC(C)(NC(=O)C(C)(C)NC(=O)C(C)NC(=O)CNC(=O)C(C)(C)NC(C)=O)C(=O)NC(CCC(N)=O)C(=O)NC(C)(C)C(=O)NC(C(=O)NC(C)(C)C(=O)NCC(=O)NC(CC(C)C)C(=O)NC(C)(C)C(=O)N1CCCC1C(=O)NC(CC(C)C)C(=O)NC(C)(C)C(=O)NC(C)(CC)C(=O)NC(CCC(N)=O)C(=O)NC(CO)CC(C)C)C(C)C
InChI	InChI=1S/C81H142N20O21/c1-27-80(25,71(120)90-49(31-33-54(82)104)60(109)87-48(41-102)36-42(3)4)100-70(119)78(21,22)96-63(112)52(38-44(7)8)89-64(113)53-30-29-35-101(53)73(122)79(23,24)97-62(111)51(37-43(5)6)88-57(107)40-85-67(116)75(15,16)98-65(114)58(45(9)10)92-68(117)76(17,18)95-61(110)50(32-34-55(83)105)91-72(121)81(26,28-2)99-69(118)77(19,20)94-59(108)46(11)86-56(106)39-84-66(115)74(13,14)93-47(12)103/h42-46,48-53,58,102H,27-41H2,1-26H3,(H2,82,104)(H2,83,105)(H,84,115)(H,85,116)(H,86,106)(H,87,109)(H,88,107)(H,89,113)(H,90,120)(H,91,121)(H,92,117)(H,93,103)(H,94,108)(H,95,110)(H,96,112)(H,97,111)(H,98,114)(H,99,118)(H,100,119)
InChIKey	DEKKUTJHZZBCAC-UHFFFAOYSA-N

Species of Metabolite	Component	Source	Comments
Trichoderma harzianum (ncbitaxon:5544)	-	PubMed (8557564)

Roles Classification

Chemical Role:

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

ChEBI Ontology

Outgoing Relation(s)
	Trichorzin HA-5 (CHEBI:220852) 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]-2-methylpropanoyl]amino]-2-methylbutanoyl]amino]-5-amino-5-oxopentanoyl]amino]-2-methylpropanoyl]amino]-3-methylbutanoyl]amino]-2-methylpropanoyl]amino]acetyl]amino]-4-methylpentanoyl]amino]-2-methylpropanoyl]pyrrolidine-2-carbonyl]amino]-4-methylpentanoyl]amino]-2-methylpropanoyl]amino]-2-methylbutanoyl]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]-2-methylpropanoyl]amino]-2-methylbutanoyl]amino]-5-amino-5-oxopentanoyl]amino]-2-methylpropanoyl]amino]-3-methylbutanoyl]amino]-2-methylpropanoyl]amino]acetyl]amino]-4-methylpentanoyl]amino]-2-methylpropanoyl]pyrrolidine-2-carbonyl]amino]-4-methylpentanoyl]amino]-2-methylpropanoyl]amino]-2-methylbutanoyl]amino]-N-(1-hydroxy-4-methylpentan-2-yl)pentanediamide

Manual Xrefs	Databases
78444331	ChemSpider