EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C63H110N11O17S |
| Net Charge | +1 |
| Average Mass | 1325.700 |
| Monoisotopic Mass | 1324.77964 |
| SMILES | C/C=C1/NC(=O)C(NC(=O)[C@H](C)NC(=O)C(C)C(O)CCCCCCC/C=C\CCCCCCC(O)CC(O)CC(O)CC(O)CC(O)CCC(O)C[N+](C)(C)C)CC2(CS/C=C\NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC2=O)NC(=O)[C@H](C(C)C)NC1=O |
| InChI | InChI=1S/C63H109N11O17S/c1-9-47-58(87)72-54(38(2)3)61(90)73-63(37-92-28-27-66-57(86)48(33-52(64)82)69-59(88)49(34-53(65)83)71-62(63)91)35-50(60(89)68-47)70-56(85)40(5)67-55(84)39(4)51(81)24-22-20-18-16-14-12-10-11-13-15-17-19-21-23-41(75)29-44(78)31-46(80)32-45(79)30-42(76)25-26-43(77)36-74(6,7)8/h9-11,27-28,38-46,48-51,54,75-81H,12-26,29-37H2,1-8H3,(H11-,64,65,66,67,68,69,70,71,72,73,82,83,84,85,86,87,88,89,90,91)/p+1/b11-10-,28-27-,47-9+/t39?,40-,41?,42?,43?,44?,45?,46?,48-,49-,50?,51?,54-,63?/m0/s1 |
| InChIKey | UTSUZMAMEICBLB-WBDLBRFUSA-O |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Streptomycesspecies TP-A0584 (ncbitaxon:314563) | - | PubMed (32719482) |
| Roles Classification |
|---|
| Chemical Role: | Bronsted base A molecular entity capable of accepting a hydron from a donor (Brønsted acid). |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Goadvionin A1 (CHEBI:220770) is a polypeptide (CHEBI:15841) |