Record Information
Version1.0
StatusDetected and Quantified
Creation Date2021-05-15 07:44:48 UTC
Update Date2022-08-31 06:42:14 UTC
MiMeDB IDMMDBc0017335
Metabolite Identification
Common NameFungal ferritin
DescriptionFungal ferritin belongs to the class of organic compounds known as polypeptides. These are peptides containing ten or more amino acid residues. Based on a literature review a significant number of articles have been published on Fungal ferritin.
Structure
SynonymsNot Available
Chemical FormulaC50H78N14O17S
Average Molecular Weight1179.32
Monoisotopic Molecular Weight1178.539008282
IUPAC Name4-[({1-[2-({2-[(2-{[2-amino-1-hydroxy-3-(methylsulfanyl)propylidene]amino}-5-carbamimidamido-1-hydroxypentylidene)amino]-1-hydroxyethylidene}amino)-3-(C-hydroxycarbonimidoyl)propanoyl]pyrrolidin-2-yl}(hydroxy)methylidene)amino]-4-{[1-({1-[(2-carboxy-1-{[1-carboxy-2-(4-hydroxyphenyl)ethyl]-C-hydroxycarbonimidoyl}ethyl)-C-hydroxycarbonimidoyl]-2-methylbutyl}-C-hydroxycarbonimidoyl)-2-methylpropyl]-C-hydroxycarbonimidoyl}butanoic acid
Traditional Name4-[({1-[2-({2-[(2-{[2-amino-1-hydroxy-3-(methylsulfanyl)propylidene]amino}-5-carbamimidamido-1-hydroxypentylidene)amino]-1-hydroxyethylidene}amino)-3-(C-hydroxycarbonimidoyl)propanoyl]pyrrolidin-2-yl}(hydroxy)methylidene)amino]-4-{[1-({1-[(2-carboxy-1-{[1-carboxy-2-(4-hydroxyphenyl)ethyl]-C-hydroxycarbonimidoyl}ethyl)-C-hydroxycarbonimidoyl]-2-methylbutyl}-C-hydroxycarbonimidoyl)-2-methylpropyl]-C-hydroxycarbonimidoyl}butanoic acid
CAS Registry NumberNot Available
SMILES
CCC(C)C(N=C(O)C(N=C(O)C(CCC(O)=O)N=C(O)C1CCCN1C(=O)C(CC(O)=N)N=C(O)CN=C(O)C(CCCNC(N)=N)N=C(O)C(N)CSC)C(C)C)C(O)=NC(CC(O)=O)C(O)=NC(CC1=CC=C(O)C=C1)C(O)=O
InChI Identifier
InChI=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)
InChI KeyLYYQYJLSWPMKAR-UHFFFAOYSA-N