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CHEBI:213080 - Trichocellin-A-VI

ChEBI IDCHEBI:213080
ChEBI NameTrichocellin-A-VI
Stars
SubmitterMetaboLights
DownloadsMolfile
FormulaC92H153N23O24
Net Charge0
Average Mass1965.373
Monoisotopic Mass1964.14588
SMILESCCC(C)(NC(=O)C(C)(C)NC(=O)C(NC(=O)C1CCCN1C(=O)C(C)(C)NC(=O)C(CC(C)C)NC(=O)CNC(=O)C(C)(C)NC(=O)C(CC(C)C)NC(=O)C(C)(C)NC(=O)C(CCC(N)=O)NC(=O)C(C)NC(=O)C(C)(C)NC(=O)C(C)NC(=O)C(C)(C)NC(=O)C(C)NC(=O)C(C)(C)NC(C)=O)C(C)C)C(=O)NC(CCC(N)=O)C(=O)NC(CCC(N)=O)C(=O)NC(CO)Cc1ccccc1
InChIInChI=1S/C92H153N23O24/c1-27-92(26,83(138)104-57(36-39-63(94)119)71(126)103-56(35-38-62(93)118)70(125)100-55(46-116)44-54-32-29-28-30-33-54)114-82(137)90(22,23)113-76(131)66(49(6)7)106-75(130)61-34-31-41-115(61)84(139)91(24,25)112-73(128)59(42-47(2)3)101-65(121)45-96-77(132)85(12,13)111-74(129)60(43-48(4)5)105-81(136)89(20,21)110-72(127)58(37-40-64(95)120)102-67(122)50(8)97-79(134)87(16,17)108-69(124)52(10)99-80(135)88(18,19)109-68(123)51(9)98-78(133)86(14,15)107-53(11)117/h28-30,32-33,47-52,55-61,66,116H,27,31,34-46H2,1-26H3,(H2,93,118)(H2,94,119)(H2,95,120)(H,96,132)(H,97,134)(H,98,133)(H,99,135)(H,100,125)(H,101,121)(H,102,122)(H,103,126)(H,104,138)(H,105,136)(H,106,130)(H,107,117)(H,108,124)(H,109,123)(H,110,127)(H,111,129)(H,112,128)(H,113,131)(H,114,137)
InChIKeyGTYCTZPHNVWRBI-UHFFFAOYSA-N
Species of MetaboliteComponentSourceComments
Trichoderma viride (ncbitaxon:5547) - DOI (10.1016/s0040-4039(00)76838-9)
Roles Classification
Chemical Role:
Bronsted base  A molecular entity capable of accepting a hydron from a donor (Brønsted acid).
ChEBI Ontology
Outgoing Relation(s)
Trichocellin-A-VI (CHEBI:213080) is a polypeptide (CHEBI:15841)
IUPAC Name 
N-[1-[1-[1-[2-[1-[1-[2-[N-[1-[1-[1-[1-[1,5-dihydroxy-1-(1-hydroxy-3-phenylpropan-2-yl)imino-5-iminopentan-2-yl]imino-1,5-dihydroxy-5-iminopentan-2-yl]imino-1-hydroxy-2-methylbutan-2-yl]imino-1-hydroxy-2-methylpropan-2-yl]imino-1-hydroxy-3-methylbutan-2-yl]-C-hydroxycarbonimidoyl]pyrrolidin-1-yl]-2-methyl-1-oxopropan-2-yl]imino-1-hydroxy-4-methylpentan-2-yl]imino-2-hydroxyethyl]imino-1-hydroxy-2-methylpropan-2-yl]imino-1-hydroxy-4-methylpentan-2-yl]imino-1-hydroxy-2-methylpropan-2-yl]-2-[[1-hydroxy-2-[[1-hydroxy-2-[[1-hydroxy-2-[[1-hydroxy-2-[[1-hydroxy-2-[[1-hydroxy-2-(1-hydroxyethylideneamino)-2-methylpropylidene]amino]propylidene]amino]-2-methylpropylidene]amino]propylidene]amino]-2-methylpropylidene]amino]propylidene]amino]pentanediimidic acid
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