Trichorzin PA VII (CHEBI:201856)

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CHEBI:201856 - Trichorzin PA VII

ChEBI ID	CHEBI:201856
ChEBI Name	Trichorzin PA VII
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C88H145N21O22
Net Charge	0
Average Mass	1849.253
Monoisotopic Mass	1848.08731
SMILES	CCC(C)(NC(=O)C(C)NC(=O)C(CO)NC(=O)C(C)(C)NC(C)=O)C(=O)NC(C)(CC)C(=O)NC(CCC(N)=O)C(=O)NC(C)(CC)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)(C)C(=O)NC(CCC(N)=O)C(=O)NC(CO)Cc1cnc2ccccc12)C(C)C
InChI	InChI=1S/C88H145N21O22/c1-25-86(22,106-68(119)56(35-37-62(90)114)98-77(128)87(23,26-2)108-79(130)88(24,27-3)105-65(116)49(10)93-67(118)59(45-111)99-74(125)82(14,15)101-50(11)112)78(129)100-64(48(8)9)72(123)104-81(12,13)73(124)92-43-63(115)95-57(39-46(4)5)69(120)103-85(20,21)80(131)109-38-30-33-60(109)71(122)96-58(40-47(6)7)70(121)102-84(18,19)76(127)107-83(16,17)75(126)97-55(34-36-61(89)113)66(117)94-52(44-110)41-51-42-91-54-32-29-28-31-53(51)54/h28-29,31-32,42,46-49,52,55-60,64,91,110-111H,25-27,30,33-41,43-45H2,1-24H3,(H2,89,113)(H2,90,114)(H,92,124)(H,93,118)(H,94,117)(H,95,115)(H,96,122)(H,97,126)(H,98,128)(H,99,125)(H,100,129)(H,101,112)(H,102,121)(H,103,120)(H,104,123)(H,105,116)(H,106,119)(H,107,127)(H,108,130)
InChIKey	JZVMUICLHZEPCW-UHFFFAOYSA-N

Species of Metabolite	Component	Source	Comments
Trichoderma harzianum (ncbitaxon:5544)	-	PubMed (9544938)

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 PA VII (CHEBI:201856) 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]-3-hydroxypropanoyl]amino]propanoylamino]-2-methylbutanoyl]amino]-2-methylbutanoyl]amino]-5-amino-5-oxopentanoyl]amino]-2-methylbutanoyl]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-methylpropanoyl]amino]-N-[1-hydroxy-3-(1H-indol-3-yl)propan-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]-3-hydroxypropanoyl]amino]propanoylamino]-2-methylbutanoyl]amino]-2-methylbutanoyl]amino]-5-amino-5-oxopentanoyl]amino]-2-methylbutanoyl]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-methylpropanoyl]amino]-N-[1-hydroxy-3-(1H-indol-3-yl)propan-2-yl]pentanediamide

Manual Xrefs	Databases
78443989	ChemSpider