SCH 643432 (CHEBI:206109)

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CHEBI:206109 - SCH 643432

ChEBI ID	CHEBI:206109
ChEBI Name	SCH 643432
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C98H172N24O24
Net Charge	0
Average Mass	2070.598
Monoisotopic Mass	2069.29763
SMILES	CCCCCCCCCCCC(=O)C(C)C(=O)N1CCCC1C(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NC(C)C(=O)NC(C)C(=O)NC(C)(C)C(=O)NC(CC(C)C)C(=O)NC(C)C(=O)NC(C)(C)C(=O)NC(C)C(=O)NC(C)C(=O)NC(C)(C)C(=O)NC(CCCNC(=N)N)C(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NC(C)C(=O)O
InChI	InChI=1S/C98H172N24O24/c1-35-36-37-38-39-40-41-42-43-48-63(123)53(4)72(132)122-50-45-47-62(122)71(131)114-93(23,24)80(141)118-97(31,32)84(145)119-94(25,26)81(142)115-90(17,18)75(136)106-55(6)65(125)103-57(8)67(127)112-89(15,16)78(139)109-61(51-52(2)3)69(129)104-58(9)68(128)110-87(11,12)74(135)105-54(5)64(124)102-56(7)66(126)111-88(13,14)77(138)108-60(46-44-49-101-86(99)100)70(130)113-92(21,22)79(140)117-96(29,30)83(144)121-98(33,34)85(146)120-95(27,28)82(143)116-91(19,20)76(137)107-59(10)73(133)134/h52-62H,35-51H2,1-34H3,(H,102,124)(H,103,125)(H,104,129)(H,105,135)(H,106,136)(H,107,137)(H,108,138)(H,109,139)(H,110,128)(H,111,126)(H,112,127)(H,113,130)(H,114,131)(H,115,142)(H,116,143)(H,117,140)(H,118,141)(H,119,145)(H,120,146)(H,121,144)(H,133,134)(H4,99,100,101)
InChIKey	NSPWXTOKHADAHM-UHFFFAOYSA-N

Species of Metabolite	Component	Source	Comments
Paecilomyces variotii (ncbitaxon:264951)	-	PubMed (12870808)

Roles Classification

Chemical Role:

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

ChEBI Ontology

Outgoing Relation(s)
	SCH 643432 (CHEBI:206109) is a peptide (CHEBI:16670)

IUPAC Name
2-[[2-[[2-[[2-[[2-[[2-[[5-carbamimidamido-2-[[2-methyl-2-[2-[2-[[2-methyl-2-[2-[[4-methyl-2-[[2-methyl-2-[2-[2-[[2-methyl-2-[[2-methyl-2-[[2-methyl-2-[[2-methyl-2-[[1-(2-methyl-3-oxotetradecanoyl)pyrrolidine-2-carbonyl]amino]propanoyl]amino]propanoyl]amino]propanoyl]amino]propanoyl]amino]propanoylamino]propanoylamino]propanoyl]amino]pentanoyl]amino]propanoylamino]propanoyl]amino]propanoylamino]propanoylamino]propanoyl]amino]pentanoyl]amino]-2-methylpropanoyl]amino]-2-methylpropanoyl]amino]-2-methylpropanoyl]amino]-2-methylpropanoyl]amino]-2-methylpropanoyl]amino]propanoic acid

IUPAC Name

2-[[2-[[2-[[2-[[2-[[2-[[5-carbamimidamido-2-[[2-methyl-2-[2-[2-[[2-methyl-2-[2-[[4-methyl-2-[[2-methyl-2-[2-[2-[[2-methyl-2-[[2-methyl-2-[[2-methyl-2-[[2-methyl-2-[[1-(2-methyl-3-oxotetradecanoyl)pyrrolidine-2-carbonyl]amino]propanoyl]amino]propanoyl]amino]propanoyl]amino]propanoyl]amino]propanoylamino]propanoylamino]propanoyl]amino]pentanoyl]amino]propanoylamino]propanoyl]amino]propanoylamino]propanoylamino]propanoyl]amino]pentanoyl]amino]-2-methylpropanoyl]amino]-2-methylpropanoyl]amino]-2-methylpropanoyl]amino]-2-methylpropanoyl]amino]-2-methylpropanoyl]amino]propanoic acid

Manual Xrefs	Databases
78444367	ChemSpider