EMBL-EBI | Chemical Biology | ChEBI
Example searches: iron*, InChI=1S/CH4O/c1-2/h2H,1H3, caffeine | Advanced Search
| Formula | C53H90O24 |
| Net Charge | 0 |
| Average Mass | 1111.279 |
| Monoisotopic Mass | 1110.58220 |
| SMILES | [H][C@@]12CC=C3C(C)(C)[C@@H](O[C@@H]4O[C@H](CO[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)[C@@H](O)[C@H](O[C@@H]5OC[C@@H](O)[C@H](O)[C@@H]5O)[C@H]4O)CC[C@@]3([H])[C@]1(C)CC[C@@]1(C)[C@@]2(C)CC[C@]1([H])[C@H](C)[C@H](O)[C@@H](O)[C@@H](O)C(C)(C)O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O |
| InChI | InChI=1S/C53H90O24/c1-21(31(57)38(64)44(69)50(4,5)77-48-41(67)37(63)34(60)27(18-55)73-48)22-13-14-53(8)29-11-9-23-24(51(29,6)15-16-52(22,53)7)10-12-30(49(23,2)3)75-47-42(68)43(76-46-39(65)32(58)25(56)19-70-46)35(61)28(74-47)20-71-45-40(66)36(62)33(59)26(17-54)72-45/h9,21-22,24-48,54-69H,10-20H2,1-8H3/t21-,22+,24+,25+,26+,27+,28+,29+,30-,31-,32-,33+,34+,35+,36-,37-,38+,39-,40+,41+,42+,43-,44+,45+,46-,47-,48-,51-,52+,53-/m0/s1 |
| InChIKey | HNOPPUKJGMETNF-BZSKXEQRSA-N |
| Species of Metabolite | Component | Source | Comments |
|---|---|---|---|
| Momordica charantia (ncbitaxon:3673) | seed (BTO:0001226) | MetaboLights (MTBLS701) |
| Roles Classification |
|---|
| Biological Role: | metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites. |
| ChEBI Ontology |
|---|
| Outgoing Relation(s) |
| momordicoside T (CHEBI:145189) is a 3-hydroxy steroid (CHEBI:36834) |
| momordicoside T (CHEBI:145189) is a polysaccharide derivative (CHEBI:65212) |
| momordicoside T (CHEBI:145189) is a steroid saponin (CHEBI:61655) |