EMBL-EBI | Chemical Biology | ChEBI
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| Formula | C80H107N19O19S |
| Net Charge | 0 |
| Average Mass | 1670.917 |
| Monoisotopic Mass | 1669.77113 |
| SMILES | CSCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(=O)O)NC(=O)[C@H](CCC(N)=O)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](Cc1cnc2ccccc12)NC(=O)[C@H](Cc1cncn1)NC(=O)[C@@H](N)Cc1cnc2ccccc12)C(=O)N[C@@H](Cc1ccc(O)cc1)C(=O)O |
| InChI | InChI=1S/C80H107N19O19S/c1-42(2)30-57(93-74(111)58(34-46-38-86-53-15-9-7-13-50(46)53)94-75(112)59(35-47-39-84-41-88-47)92-69(106)51(81)33-45-37-85-52-14-8-6-12-49(45)52)73(110)90-55(23-25-66(83)102)71(108)95-60(31-43(3)4)78(115)98-27-10-16-63(98)76(113)87-40-67(103)89-54(22-24-65(82)101)70(107)96-61(36-68(104)105)79(116)99-28-11-17-64(99)77(114)91-56(26-29-119-5)72(109)97-62(80(117)118)32-44-18-20-48(100)21-19-44/h6-9,12-15,18-21,37-39,41-43,51,54-64,85-86,100H,10-11,16-17,22-36,40,81H2,1-5H3,(H2,82,101)(H2,83,102)(H,84,88)(H,87,113)(H,89,103)(H,90,110)(H,91,114)(H,92,106)(H,93,111)(H,94,112)(H,95,108)(H,96,107)(H,97,109)(H,104,105)(H,117,118)/t51-,54-,55-,56-,57-,58-,59-,60-,61-,62-,63-,64-/m0/s1 |
| InChIKey | IXKSXJFAGXLQOQ-XISFHERQSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Saccharomyces cerevisiae (ncbitaxon:4932) | - | PubMed (6306574) | Strain: ATCC 204508 / S288c |
| Roles Classification |
|---|
| Chemical Role: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). |
| Biological Role: | Saccharomyces cerevisiae metabolite Any fungal metabolite produced during a metabolic reaction in Baker's yeast (Saccharomyces cerevisiae ). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| WHWLQLKPGQPMY (CHEBI:79382) has role Saccharomyces cerevisiae metabolite (CHEBI:75772) |
| WHWLQLKPGQPMY (CHEBI:79382) is a polypeptide (CHEBI:15841) |
| IUPAC Name |
|---|
| L-tryptophyl-L-histidyl-L-tryptophyl-L-leucyl-L-glutaminyl-L-leucyl-L-prolylglycyl-L-glutaminyl-L-α-aspartyl-L-prolyl-L-methionyl-L-tyrosine |
| Synonyms | Source |
|---|---|
| L-Trp-L-His-L-Trp-L-Leu-L-Gln-L-Leu-L-Lys-L-Pro-Gly-L-Gln-L-Pro-L-Met-L-Tyr | ChEBI |
| Trp-His-Trp-Leu-Gln-Leu-Lys-Pro-Gly-Gln-Pro-Met-Tyr | ChEBI |
| α-factor | ChEBI |