Metabolites
Displaying compounds 851 - 875 of 16042 in total
| YMDB ID | Name CAS Number | IUPAC Name | Formula Weight | Structure |
|---|---|---|---|---|
| YMDB00100 | 3-Dehydroquinate 105735-75-9 | (1R,3R,4S)-1,3,4-trihydroxy-5-oxocyclohexane-1-carboxylic acid | C7H10O6 190.1507 | |
| YMDB15984 | Diethyl malate | 1,4-diethyl 2-hydroxybutanedioate | C8H14O5 190.1938 | |
| YMDB01408 | hydroxyl diethyl succinate | 1,4-diethyl 2-hydroxybutanedioate | C8H14O5 190.1938 | |
| YMDB00481 | 3-hydroxy-2-isopropyl-4-methoxy-4-oxobutanoate | 3-hydroxy-4-methoxy-4-oxo-2-(propan-2-yl)butanoic acid | C8H14O5 190.1938 | |
| YMDB16140 | Diaminopimelic acid | (2S,6S)-2,6-diaminoheptanedioic acid | C7H14N2O4 190.1971 | |
| YMDB15982 | Dehydro-beta-ionone | (3E)-4-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)but-3-en-2-one | C13H18O 190.2814 | |
| YMDB01468 | trans-beta-damascenone 23696-85-7 | (2E)-1-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)but-2-en-1-one | C13H18O 190.2814 | |
| YMDB01739 | Megastigmatrienone 13215-88-8 | (4Z)-4-[(2E)-but-2-en-1-ylidene]-3,5,5-trimethylcyclohex-2-en-1-one | C13H18O 190.2814 | |
| YMDB01375 | 1-[2,6,6-Trimethyl-1,3-cyclohexadien-1-yl]-2-buten-1-one 23696-85-7 | (2E)-1-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)but-2-en-1-one | C13H18O 190.2814 | |
| YMDB15908 | (e)-beta-Damascenone | (2E)-1-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)but-2-en-1-one | C13H18O 190.286 | |
| YMDB15913 | (z)-beta-Damascenone | (2Z)-1-(2,6,6-trimethylcyclohexa-1,3-dien-1-yl)but-2-en-1-one | C13H18O 190.286 | |
| YMDB00991 | N-acetyl-D-methionine 1509-92-8 | (2R)-2-acetamido-4-(methylsulfanyl)butanoic acid | C7H13NO3S 191.248 | |
| YMDB00026 | Isocitric acid 320-77-4 | 1-hydroxypropane-1,2,3-tricarboxylic acid | C6H8O7 192.1235 | |
| YMDB16142 | D-threo-Isocitric acid | (1R,2S)-1-hydroxypropane-1,2,3-tricarboxylic acid | C6H8O7 192.1235 | |
| YMDB00086 | Citric acid 77-92-9 | 2-hydroxypropane-1,2,3-tricarboxylic acid | C6H8O7 192.1235 | |
| YMDB15938 | 2-Phenylethyl butyrate | 2-phenylethyl butanoate | C12H16O2 192.2542 | |
| YMDB01643 | beta-Ionone 79-77-6 | (3E)-4-(2,6,6-trimethylcyclohex-1-en-1-yl)but-3-en-2-one | C13H20O 192.2973 | |
| YMDB01413 | vitispirane 65416-59-3 | 2,10,10-trimethyl-6-methylidene-1-oxaspiro[4.5]dec-7-ene | C13H20O 192.2973 | |
| YMDB15992 | Edulan i | 2,5,5,8a-tetramethyl-3,5,6,8a-tetrahydro-2H-1-benzopyran | C13H20O 192.2973 | |
| YMDB16094 | alpha-Ionone | (3E)-4-(2,6,6-trimethylcyclohex-2-en-1-yl)but-3-en-2-one | C13H20O 192.2973 | |
| YMDB16100 | beta-Damascone | (2E)-1-(2,6,6-trimethylcyclohex-1-en-1-yl)but-2-en-1-one | C13H20O 192.2973 | |
| YMDB01582 | 2-Dehydro-D-gluconate | (3S,4R,5R)-3,4,5,6-tetrahydroxy-2-oxohexanoate | C6H9O7 193.1315 | |
| YMDB01568 | N-Phenylacetylglycine 500-98-1 | 2-(2-phenylacetamido)acetic acid | C10H11NO3 193.1992 | |
| YMDB00904 | Pectin 9000-69-5 | (2S,3R,4S,5R,6R)-3,4,5,6-tetrahydroxyoxane-2-carboxylic acid | C6H10O7 194.1394 | |
| YMDB00674 | aldehydo-D-galacturonate 685-73-4 | (2S,3R,4S,5R)-2,3,4,5-tetrahydroxy-6-oxohexanoic acid | C6H10O7 194.1394 |