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CHEBI:206605 - Polysporin A

ChEBI IDCHEBI:206605
ChEBI NamePolysporin A
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC92H151N23O24
Net Charge0
Average Mass1963.357
Monoisotopic Mass1962.13023
SMILESCC(=O)NC(C)(C)C(=O)N1CCCC1C(=O)NC(C)(C)C(=O)NC(C)C(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NC(CCC(N)=O)C(=O)NC(C)(C)C(=O)NC(C(=O)NC(C)(C)C(=O)NCC(=O)NC(C(=O)NC(C)(C)C(=O)N1CCCC1C(=O)NC(C(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)NC(CCC(N)=O)C(=O)NC(CCC(N)=O)C(=O)NC(CO)Cc1ccccc1)C(C)C)C(C)C)C(C)C
InChIInChI=1S/C92H151N23O24/c1-47(2)63(72(128)111-92(25,26)83(139)114-42-30-34-57(114)70(126)103-64(48(3)4)73(129)110-90(21,22)81(137)113-87(15,16)77(133)100-55(37-40-60(94)119)68(124)99-54(36-39-59(93)118)67(123)98-53(46-116)44-52-32-28-27-29-33-52)102-62(121)45-96-75(131)84(9,10)109-74(130)65(49(5)6)104-79(135)86(13,14)107-69(125)56(38-41-61(95)120)101-78(134)88(17,18)112-80(136)89(19,20)106-66(122)50(7)97-76(132)85(11,12)108-71(127)58-35-31-43-115(58)82(138)91(23,24)105-51(8)117/h27-29,32-33,47-50,53-58,63-65,116H,30-31,34-46H2,1-26H3,(H2,93,118)(H2,94,119)(H2,95,120)(H,96,131)(H,97,132)(H,98,123)(H,99,124)(H,100,133)(H,101,134)(H,102,121)(H,103,126)(H,104,135)(H,105,117)(H,106,122)(H,107,125)(H,108,127)(H,109,130)(H,110,129)(H,111,128)(H,112,136)(H,113,137)
InChIKeySSUAIRQGSXHFLL-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Trichoderma polysporum (ncbitaxon:40695) - DOI (10.1016/0040-4039(96)00463-7)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Polysporin A (CHEBI:206605) is a polypeptide (CHEBI:15841)
IUPAC Name 
2-[[2-[[2-[[2-[[2-[[[1-[2-[[2-[[2-[[2-[[2-[[2-[[1,5-dihydroxy-2-[[1-hydroxy-2-[[1-hydroxy-2-[[1-hydroxy-2-[[1-hydroxy-2-[[hydroxy-[1-[2-(1-hydroxyethylideneamino)-2-methylpropanoyl]pyrrolidin-2-yl]methylidene]amino]-2-methylpropylidene]amino]propylidene]amino]-2-methylpropylidene]amino]-2-methylpropylidene]amino]-5-iminopentylidene]amino]-1-hydroxy-2-methylpropylidene]amino]-1-hydroxy-3-methylbutylidene]amino]-1-hydroxy-2-methylpropylidene]amino]-1-hydroxyethylidene]amino]-1-hydroxy-3-methylbutylidene]amino]-2-methylpropanoyl]pyrrolidin-2-yl]-hydroxymethylidene]amino]-1-hydroxy-3-methylbutylidene]amino]-1-hydroxy-2-methylpropylidene]amino]-1-hydroxy-2-methylpropylidene]amino]-1,5-dihydroxy-5-iminopentylidene]amino]-N-(1-hydroxy-3-phenylpropan-2-yl)pentanediimidic acid
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