RES-701-3 (CHEBI:201308)

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CHEBI:201308 - RES-701-3

ChEBI ID	CHEBI:201308
ChEBI Name	RES-701-3
Stars
Submitter	MetaboLights
Downloads	Molfile

Formula	C103H115N23O24
Net Charge	0
Average Mass	2059.190
Monoisotopic Mass	2057.84853
SMILES	C[C@@H](O)C1NC(=O)CNC(=O)C(Cc2cncn2)NC(=O)C(Cc2cnc3ccccc23)NC(=O)C(CC(N)=O)NC(=O)CNC(=O)CC(C(=O)NC(Cc2cnc3ccccc23)C(=O)NC(Cc2ccccc2)C(=O)NC(Cc2ccccc2)C(=O)NC(CC(N)=O)C(=O)NC(Cc2ccc(O)cc2)C(=O)NC(Cc2ccc(O)cc2)C(=O)NC(Cc2cnc3ccccc23)C(=O)O)NC(=O)C2CCCN2C(=O)C(CO)NC1=O
InChI	InChI=1S/C103H115N23O24/c1-54(128)89-101(147)124-82(52-127)102(148)126-34-14-25-83(126)100(146)122-80(45-86(133)110-50-87(134)113-78(43-84(104)131)97(143)118-76(40-60-47-108-69-23-12-9-20-66(60)69)96(142)120-77(42-62-49-106-53-112-62)90(136)111-51-88(135)125-89)99(145)119-75(39-59-46-107-68-22-11-8-19-65(59)68)95(141)116-71(35-55-15-4-2-5-16-55)91(137)114-72(36-56-17-6-3-7-18-56)93(139)121-79(44-85(105)132)98(144)117-73(37-57-26-30-63(129)31-27-57)92(138)115-74(38-58-28-32-64(130)33-29-58)94(140)123-81(103(149)150)41-61-48-109-70-24-13-10-21-67(61)70/h2-13,15-24,26-33,46-49,53-54,71-83,89,107-109,127-130H,14,25,34-45,50-52H2,1H3,(H2,104,131)(H2,105,132)(H,106,112)(H,110,133)(H,111,136)(H,113,134)(H,114,137)(H,115,138)(H,116,141)(H,117,144)(H,118,143)(H,119,145)(H,120,142)(H,121,139)(H,122,146)(H,123,140)(H,124,147)(H,125,135)(H,149,150)/t54-,71?,72?,73?,74?,75?,76?,77?,78?,79?,80?,81?,82?,83?,89?/m1/s1
InChIKey	RSSUBDDVAQNPLG-AEIDVDNOSA-N

Species of Metabolite	Component	Source	Comments
Streptomycesspecies (ncbitaxon:1931)	-	PubMed (8557559)

Roles Classification

Chemical Role:

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

ChEBI Ontology

Outgoing Relation(s)
	RES-701-3 (CHEBI:201308) is a polypeptide (CHEBI:15841)

IUPAC Name
2-[[2-[[2-[[1,4-dihydroxy-2-[[1-hydroxy-2-[[1-hydroxy-2-[[1-hydroxy-2-[[hydroxy-[5,8,11,14,17,20,23,27-octahydroxy-6-[(1R)-1-hydroxyethyl]-18-(2-hydroxy-2-iminoethyl)-3-(hydroxymethyl)-12-(1H-imidazol-5-ylmethyl)-15-(1H-indol-3-ylmethyl)-2-oxo-1,4,7,10,13,16,19,22,26-nonazabicyclo[26.3.0]hentriaconta-4,7,10,13,16,19,22,26-octaen-25-yl]methylidene]amino]-3-(1H-indol-3-yl)propylidene]amino]-3-phenylpropylidene]amino]-3-phenylpropylidene]amino]-4-iminobutylidene]amino]-1-hydroxy-3-(4-hydroxyphenyl)propylidene]amino]-1-hydroxy-3-(4-hydroxyphenyl)propylidene]amino]-3-(1H-indol-3-yl)propanoic acid

IUPAC Name

2-[[2-[[2-[[1,4-dihydroxy-2-[[1-hydroxy-2-[[1-hydroxy-2-[[1-hydroxy-2-[[hydroxy-[5,8,11,14,17,20,23,27-octahydroxy-6-[(1R)-1-hydroxyethyl]-18-(2-hydroxy-2-iminoethyl)-3-(hydroxymethyl)-12-(1H-imidazol-5-ylmethyl)-15-(1H-indol-3-ylmethyl)-2-oxo-1,4,7,10,13,16,19,22,26-nonazabicyclo[26.3.0]hentriaconta-4,7,10,13,16,19,22,26-octaen-25-yl]methylidene]amino]-3-(1H-indol-3-yl)propylidene]amino]-3-phenylpropylidene]amino]-3-phenylpropylidene]amino]-4-iminobutylidene]amino]-1-hydroxy-3-(4-hydroxyphenyl)propylidene]amino]-1-hydroxy-3-(4-hydroxyphenyl)propylidene]amino]-3-(1H-indol-3-yl)propanoic acid

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