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CHEBI:230094 - Annomuricatin B
| Formula | C35H49N9O9 |
| Net Charge | 0 |
| Average Mass | 739.831 |
| Monoisotopic Mass | 739.36532 |
| SMILES | CC(C)CC1NC(=O)C(Cc2cnc3ccccc23)NC(=O)C(C)NC(=O)C(CC(N)=O)NC(=O)C2CCCN2C(=O)C(C(C)O)NC(=O)CNC1=O |
| InChI | InChI=1S/C35H49N9O9/c1-17(2)12-23-31(49)38-16-28(47)43-29(19(4)45)35(53)44-11-7-10-26(44)34(52)42-25(14-27(36)46)32(50)39-18(3)30(48)40-24(33(51)41-23)13-20-15-37-22-9-6-5-8-21(20)22/h5-6,8-9,15,17-19,23-26,29,37,45H,7,10-14,16H2,1-4H3,(H2,36,46)(H,38,49)(H,39,50)(H,40,48)(H,41,51)(H,42,52)(H,43,47) |
| InChIKey | DHPZPVONGOOZPQ-UHFFFAOYSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Mus musculus (ncbitaxon:10090) | feces (BTO:0000440) | MetaboLights (MTBLS9100) |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| Annomuricatin B (CHEBI:230094) is a organic molecular entity (CHEBI:50860) |
| IUPAC Name |
|---|
| 2-[3-(1-hydroxyethyl)-12-(1H-indol-3-ylmethyl)-15-methyl-9-(2-methylpropyl)-2,5,8,11,14,17,20-heptaoxo-1,4,7,10,13,16,19-heptazabicyclo[19.3.0]tetracosan-18-yl]acetamide |
| Manual Xrefs | Databases |
|---|---|
| HMDB0303182 | HMDB |