EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C65H116N11O16S |
| Net Charge | +1 |
| Average Mass | 1339.771 |
| Monoisotopic Mass | 1338.83167 |
| 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)CCCC[N+](C)(C)C)CC2(CSCCNC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCC(N)=O)NC2=O)NC(=O)[C@H]([C@@H](C)CC)NC1=O |
| InChI | InChI=1S/C65H115N11O16S/c1-9-41(3)56-63(91)75-65(40-93-33-31-68-59(87)51(38-55(67)84)71-61(89)50(73-64(65)92)29-30-54(66)83)39-52(62(90)70-49(10-2)60(88)74-56)72-58(86)43(5)69-57(85)42(4)53(82)28-23-21-19-17-15-13-11-12-14-16-18-20-22-26-44(77)34-46(79)36-48(81)37-47(80)35-45(78)27-24-25-32-76(6,7)8/h10-12,41-48,50-53,56,77-82H,9,13-40H2,1-8H3,(H11-,66,67,68,69,70,71,72,73,74,75,83,84,85,86,87,88,89,90,91,92)/p+1/b12-11-,49-10+/t41-,42?,43-,44?,45?,46?,47?,48?,50-,51-,52?,53?,56-,65?/m0/s1 |
| InChIKey | RBASWPBMBGCXRO-SFSVPYNKSA-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 B2 (CHEBI:220762) is a polypeptide (CHEBI:15841) |