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CHEBI:225958 - Fungal ferritin

ChEBI IDCHEBI:225958
ChEBI NameFungal ferritin
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC50H78N14O17S
Net Charge0
Average Mass1179.322
Monoisotopic Mass1178.53901
SMILESCCC(C)C(NC(=O)C(NC(=O)C(CCC(=O)O)NC(=O)C1CCCN1C(=O)C(CC(N)=O)NC(=O)CNC(=O)C(CCCN=C(N)N)NC(=O)C(N)CSC)C(C)C)C(=O)NC(CC(=O)O)C(=O)NC(Cc1ccc(O)cc1)C(=O)O
InChIInChI=1S/C50H78N14O17S/c1-6-25(4)40(47(78)60-31(21-38(70)71)44(75)61-33(49(80)81)19-26-11-13-27(65)14-12-26)63-46(77)39(24(2)3)62-43(74)30(15-16-37(68)69)59-45(76)34-10-8-18-64(34)48(79)32(20-35(52)66)57-36(67)22-56-42(73)29(9-7-17-55-50(53)54)58-41(72)28(51)23-82-5/h11-14,24-25,28-34,39-40,65H,6-10,15-23,51H2,1-5H3,(H2,52,66)(H,56,73)(H,57,67)(H,58,72)(H,59,76)(H,60,78)(H,61,75)(H,62,74)(H,63,77)(H,68,69)(H,70,71)(H,80,81)(H4,53,54,55)
InChIKeyLYYQYJLSWPMKAR-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Pseudomonas aeruginosa (ncbitaxon:287) - DOI (10.1016/0014-5793(96)00667-9)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Fungal ferritin (CHEBI:225958) is a polypeptide (CHEBI:15841)
IUPAC Name 
4-[[1-[4-amino-2-[[2-[[2-[(2-amino-3-methylsulanylpropanoyl)amino]-5-(diaminomethylideneamino)pentanoyl]amino]acetyl]amino]-4-oxobutanoyl]pyrrolidine-2-carbonyl]amino]-5-[[1-[[1-[[3-carboxy-1-[[1-carboxy-2-(4-hydroxyphenyl)ethyl]amino]-1-oxopropan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-5-oxopentanoic acid
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