Exact Mass: 258.1299
Exact Mass Matches: 258.1299
Found 500 metabolites which its exact mass value is equals to given mass value 258.1299
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
3-O-Methylbatatasin III
3-O-methylbatatasin III is a stilbenoid. 3-O-Methylbatatasin III is a natural product found in Coelogyne ovalis, Pleione bulbocodioides, and other organisms with data available. 3'-O-Methylbatatasin III shows spasmolytic activity[1]. 3'-O-Methylbatatasin III shows spasmolytic activity[1].
cyclo(dehydrophenylalanyl-L-leucyl)
Carbapenem biosynthesis intermediate 5
3-[(2-aminoethyl)sulfanyl]-6-ethyl-7-oxo-1-azabicyclo[3.2.0]heptane-2-carboxylic acid is a beta-lactam that is 7-oxo-1-azabicyclo[3.2.0]heptane-2-carboxylic acid carrying additional (2-aminoethyl)sulfanyl and ethyl substituents at positions 3 and 6 respectively. An intermediate in the biosynthesis of carbapenem. It has a role as a bacterial metabolite. It is a beta-lactam, an aliphatic sulfide, a monocarboxylic acid, an organic heterobicyclic compound and a primary amino compound. Carbapenem biosynthesis intermediate 5 is a natural product found in Streptomyces cattleya, Apis cerana, and Euglena gracilis with data available.
gamma-L-Glutamyl-L-pipecolic acid
gamma-L-Glutamyl-L-pipecolic acid is found in green vegetables. gamma-L-Glutamyl-L-pipecolic acid is isolated from the seeds of Gleditisia caspica (Caspian locust). Isolated from the seeds of Gleditisia caspica (Caspian locust). gamma-L-Glutamyl-L-pipecolic acid is found in green vegetables.
Strobilurin A
Strobilurin A is found in mushrooms. Strobilurin A is produced by Oudemansiella mucida, (porcelain fungus) and many other fung D010575 - Pesticides > D005659 - Fungicides, Industrial > D000073739 - Strobilurins D000890 - Anti-Infective Agents > D000935 - Antifungal Agents
(2S,2'S)-Pyrosaccharopine
(2S,2S)-Pyrosaccharopine is found in cereals and cereal products. (2S,2S)-Pyrosaccharopine is isolated from edible dried shiitake mushroom (Lentinus edodes) and buckwheat seeds (Fagopyrum esculentum). Isolated from edible dried shiitake mushroom (Lentinus edodes) and buckwheat seeds (Fagopyrum esculentum). (2S,2S)-Pyrosaccharopine is found in mushrooms and cereals and cereal products.
1,1'-(Tetrahydro-6a-hydroxy-2,3a,5-trimethylfuro[2,3-d]-1,3-dioxole-2,5-diyl)bis-ethanone
1,1-(Tetrahydro-6a-hydroxy-2,3a,5-trimethylfuro[2,3-d]-1,3-dioxole-2,5-diyl)bis-ethanone is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]")
2-Naphthylaminomethyl-gamma-aminobutyric acid
6-Nitroquipazine
D018377 - Neurotransmitter Agents > D018490 - Serotonin Agents > D012702 - Serotonin Antagonists
L-enantiomer
1,4-Dihydro-4-oxo-3-(2-pyrrolidinyl)-2-quinolinecarboxylic acid
acetic acid 4-acetoxy-6-hydroxy-1-(2-hydroxyethyl)hexa-1,3-dienyl ester|citrantifidiene
(+)-3-acetoxy-tetradeca-4t,6t,12t-triene-8,10-diyn-1-ol|3-Acetoxy-tetradecatrien-(4,6,12)-diin-(8,10)-ol-(1) (3R?)-3-Acetoxy-tetradeca-4t,6t,12t-trien-8,10-diin-1-ol
2,6-Diamino-2,3,4,6-tetradeoxy-erythro-hexose,9CI,8CI-Me glycoside, 2,6-di-N-Ac,6-N-Me
(2E,5E)-2-methyl-6-(7-oxo-3-methylocta-2,5-dienyl)-1,4-benzoquinone
3(2-pyrrolidinyl)-KYNA|3-(2-pyrrolidinyl)-kynurenic acid
3-(3,3-dimethyl-2-propenyl)-4-methoxy-5-phenyl-2(5H)-furanone
1-acetoxy-3-(trans-3-nona-1t,7t-diene-3,5-diynyl-oxiranyl)-propane|1-Acetoxy-4,5-epoxy-tetradeca-8,10-diin-6,12-dien
(4S,6S)-4-hydroxy-3-methoxy-6-(1-phenyl-2-propenyl)-2-cyclohexene-1-one
gamma-L-glutamyl-L(+)-2-amino-3-methylenepentenoic acid
Tensyuic acid B
A tensyuic acid that is itaconic acid which has been substituted at position 3 by a 5-(methoxycarbonyl)pentyl group. The (-)-isomer, isolated from Aspergillus niger FKI-2342.
dimethyl 2-(6-hydroxyhexyl)-3-methylenesuccinic acid
1-[(2-Methylene-3-oxo-4,5-dimethyl-4-cyclopentene)-1-ylmethyl]-3,4-dimethyl-3-cyclopentene-2,5-dione
(4S)-4,10,11-trihydroxy-10-methyldodec-2-en-1,4-olide
(3S,6S)-1,4-dihydroxy-3,6-bis<(1R)-1-methylpropyl>piperazine-2,5-dione (terramide A)|(3S,6S)-1,4-dihydroxy-3,6-bis[(1R)-1-methylpropyl]piperazine-2,5-dione (terramide A)|terramide A
4-hydroxy-3-methoxy-4-(3-phenyl-2-propenyl)-2-cyclohexene-1-one
2-Acetyl-5-(3-methyl-2-butenyl)-6-methoxybenzofuran
4-hydroxy-3,5,5-trimethyl-4-(1,2,3-trihydroxybutyl)cyclohex-2-enone|angelicol A
(+-)-1-Acetoxy-tetradeca-4,6,12-trien-8,10-diin-3-ol
1-(4-Methoxy-9H-pyrido[3,4-b]indol-1-yl)ethane-1,2-diol
Ac-(E,E)-form-9-(Tetrahydropyran-2-yl)-2,8-nonadiene-4,6-diyn-1-ol
2,6-Diamino-2,3,4,6-tetradeoxy-erythro-hexose,9CI,8CI-Et glycoside, 2,6-di-N-Ac
trans-7,9-dihydroxy-3-methyl-8-oxo-dodecan-4-olide
2-Thioxo-5-ethyl-5-(3-hydroxy-3-methylbutyl)-2,3-dihydropyrimidine-4,6(1H,5H)-dione
3-Methoxy-7-hydroxy-cadalenal|3-Methoxy-7-hydroxycadalenal|3-Methoxy-7-hydroxycadenal
erythro-1-(2-methoxyphenyl)-3-phenylpropane-1,2-diol|threo-1-(2-methoxyphenyl)-3-phenylpropane-1,2-diol
dimethyl 2-(5-hydroxyhexyl)-3-methylenesuccinic acid
O8-Me-8-Hydroxy-1(6),2,4,7(11)-cadinatetraen-12,8-olide
44SF3SS9W7
2-[3-(4-Hydroxyphenyl)propyl]-5-methoxyphenol is a natural product found in Broussonetia papyrifera and Anemarrhena asphodeloides with data available.
sn-Glycero-3-phosphocholine 1:1 cadmium chloride adduct
2-methoxy-5-methyl-3-(2-methylbut-3-en-2-yl)chromen-4-one
2-methoxy-5-methyl-3-(2-methylbut-3-en-2-yl)chromen-4-one
2-methoxy-5-methyl-3-(2-methylbut-3-en-2-yl)chromen-4-one [IIN-based on: CCMSLIB00000846302]
2-methoxy-5-methyl-3-(2-methylbut-3-en-2-yl)chromen-4-one [IIN-based: Match]
Mucidin
An enoate ester that is the methyl ester of (2E,3Z,5E)-2-(methoxymethylene)-3-methyl-6-phenylhexa-3,5-dienoic acid. D010575 - Pesticides > D005659 - Fungicides, Industrial > D000073739 - Strobilurins D000890 - Anti-Infective Agents > D000935 - Antifungal Agents
Diacetyl trimer
2-METHYL-6-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-BENZO[D]IMIDAZOLE
1-(1H-Indol-3-ylmethyl)piperidine-4-carboxylic acid
Shi epoxidation catalyst, L-enantiomer
Ethyl 4-(5-Cyclopropyl-1,2,4-oxadiazol-3-yl)benzoate
6-BENZOYL-3,4-DIMETHYL-3-CYCLOHEXENE-1-CARBOXYLIC ACID
Lorbamate
C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic
ethyl 2,5-dimethyl-1-(pyridin-4-ylmethyl)pyrrole-3-carboxylate
12-OXO-6,7,8,9,10,12-HEXAHYDRO-AZEPINO[2,1-B]QUINAZOLINE-3-CARBOXYLIC ACID
5-Methyl-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrolo[2,3-b]pyridine
2-methyl-4-(tetramethyl-1,3,2-dioxaborolan-2-yl)-2H-indazole
2-METHYL-5-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-2H-INDAZOLE
3-methyl-5-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indazole
tert-butyl 6-cyano-3,4-dihydroisoquinoline-2(1H)-carboxylate
METHYL 1-CYCLOHEXYL-1H-BENZO[D]IMIDAZOLE-5-CARBOXYLATE
Methyl 1-cyclohexyl-1H-benzo[d]imidazole-6-carboxylate
2-[(4-methylpiperazin-1-yl)methyl]-1H-quinazolin-4-one
3-AMINO-3-(4-DIMETHYLAMINO-NAPHTHALEN-1-YL)-PROPIONIC ACID
benzyl N-(6-methyl-2-oxo-1H-pyridin-3-yl)carbamate
3-methyl-5-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-pyrrolo[2,3-b]pyridine
2-methyl-5-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1h-pyrrolo[2,3-b]pyridine
4,4,5,5-Tetramethyl-2-(2,3,4-trifluorophenyl)-1,3,2-dioxaborolane
1-METHYL-4-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-1H-INDAZOLE
(2S, 4R)-Boc-4-amino Pyrrolidine-2-carboxylate acid ethylester-HCl
Amino(1-{[(2-methyl-2-propanyl)oxy]carbonyl}-4-piperidinyl)acetic acid
4,4,5,5-tetramethyl-2-(2,4,5-trifluorophenyl)-1,3,2-dioxaborolane
(R)-1-tert-Butyl 2-ethyl piperazine-1,2-dicarboxylate
3-Pyridazinecarboxamide, 6-[[(4-methoxyphenyl)methyl]amino]-
3-[(ETHOXYCARBONYL)OXYCARBONYL]-2,5-DIHYDRO-2,2,5,5-TETRAMETHYL-1H-PYRROL-1-YLOXY
(R)-3-METHOXYCARBONYLMETHYL-PIPERAZINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
5-CYANOAMINO-INDAZOLE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
(4aS-cis)-4,4a,5,6,7,8-Hexahydro-1,4a-dimethyl-7-(1-methylethenyl)-2(3H)-naphthalenone
3a,4,5,6,7,7a-hexahydro-2-benzofuran-1,3-dione,2,2-dimethylpropane-1,3-diol
1-(methoxymethyl)-4-[4-(methoxymethyl)phenoxy]benzene
Aspartic acid beta-naphthylamide
D018377 - Neurotransmitter Agents > D018846 - Excitatory Amino Acids
7-ISOPROPOXY-6-METHOXY-4-OXO-1,4-DIHYDROQUINOLINE-3-CARBONITRILE
(R,R)-7-AMINO-3-(1-METHYLPYRROLIDINIO)METHYL-3-CEPHEM-4-CARBOXYLATEHCL
4-[(E)-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)ethenyl]benzaldehyde
(2,2-DIMETHYL-1-PYRROLIDIN-1-YLMETHYL-PROPYL)-METHYL-CARBAMICACIDBENZYLESTER
formaldehyde,4-[2-(4-hydroxyphenyl)propan-2-yl]phenol
4-CARBOXYMETHYL-3-OXO-PIPERAZINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
1-oxo-2,3,4,9-tetrahydro-1h-b-carboline-6-carboxylic acid ethyl ester
a-D-erythro-Hex-2-enopyranoside,ethyl 2,3-dideoxy-, 4,6-diacetate
2-methyl-7-(tetramethyl-1,3,2-dioxaborolan-2-yl)-2H-indazole
3-(4-METHYL-6-OXO-2-PHENYL-1,6-DIHYDROPYRIMIDIN-5-YL)PROPANOIC ACID
3-formyll-trans-beta-styrylboronic acid pinacol ester
N-[4-[1-hydroxy-2-(methylamino)propyl]phenyl]methanesulfonamide
2-(4-([(TERT-BUTOXY)CARBONYL]AMINO)PIPERIDIN-1-YL)ACETIC ACID
1-methyl-5-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indazole
2-methyl-6-(tetramethyl-1,3,2-dioxaborolan-2-yl)-2H-indazole
7-BENZYL-1,4-DIOXA-7-AZASPIRO[4.5]DECANE-8-CARBONITRILE
7-Isopropoxy-6-methoxy-4-oxo-3,4-dihydro-3-quinolinecarbonitrile
(S)-3-METHOXYCARBONYLMETHYL-PIPERAZINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
Pentalene, 1,3a,4,6a-tetrahydro-3,6-diphenyl-, (3aR,6aR)
(3R,4S)-REL-1-TERT-BUTYL 3-ETHYL 4-AMINOPYRROLIDINE-1,3-DICARBOXYLATE
4-MethoxycarbonylMethyl-piperazine-1-carboxylic acid tert-butyl ester
1-Boc-3(R )-(methoxycarbonylmethyl-amino)pyrrolidine
(2S,4S)-1-tert-butyl 2-Methyl 4-(aminomethyl)pyrrolidine-1,2-dicarboxylate
(2S,4R)-1-tert-butyl 2-Methyl 4-(aminomethyl)pyrrolidine-1,2-dicarboxylate
4,4,5,5-tetramethyl-2-(2,4,6-trifluorophenyl)-1,3,2-dioxaborolane
3-(1-tert-butoxycarbonylpiperazin-4-yl)propionic acid
TERT-BUTYL (4-(2-HYDROXYPROPAN-2-YL)THIAZOL-2-YL)CARBAMATE
(1S,2R)-2-[[2-(hydroxyamino)-2-oxoethyl]-methylcarbamoyl]cyclohexane-1-carboxylic acid
TERT-BUTYL 2-(2-METHOXY-2-OXOETHYL)PIPERAZINE-1-CARBOXYLATE
(3AS,4R,6R,7AS)-TETRAHYDRO-4-HYDROXYMETHYL-6-METHOXY-4H-FURO[3,2-C]PYRAN-2(3H)-ONE
tert-butyl 2-(2-chloroethyl)-2-cyanopyrrolidine-1-carboxylate
O,O-Di(ethyl-d10) O-(2-pyrazinyl) phosphorothioate
2-((TERT-BUTOXYCARBONYL)AMINO)-2-(PIPERIDIN-4-YL)ACETIC ACID
BIOTIN METHYL ESTER
trans-4-Boc-amino-piperidine-3-carboxylic acid Methyl ester
2-AMINO-2-(1-(TERT-BUTOXYCARBONYL)PIPERIDIN-4-YL)ACETIC ACID
1-propan-2-yl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic acid
1-(5-HYDROXY-3-METHYL-1-PHENYL-1H-PYRAZOL-4-YL)BUTANE-1,3-DIONE
(S)-2-(3-((TERT-BUTOXYCARBONYL)AMINO)-2-OXOPYRROLIDIN-1-YL)ACETIC ACID
Pelubiprofen
C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent > C2198 - Nonnarcotic Analgesic
N-[(4-Aminophenyl)methyl]carbamic acid 1,1-dimethylethyl ester hydrochloride
1,2:5,6-di-o-isopropylidene-alpha-d-ribo-3-hexulofuranose
2-(1-(TERT-BUTOXYCARBONYL)-3-OXOPIPERAZIN-2-YL)ACETIC ACID
N-[(1S)-4-Cyano-2,3-dihydro-1H-inden-1-yl]carbamic acid 1,1-dimethylethyl ester
tert-Butyl (4R-cis)-6-formaldehydel-2,2-dimethyl-1,3-dioxane-4-acetate
(1R,4R)-N-(3-Fluoro-benzyl)-cyclohexane-1,4-diaMine hydrochloride
methyl2-((1R,3R)-3-amino-1-hydroxy-4-methylpentyl)thiazole-4-carboxylate
(S)-tert-butyl (4-cyano-2,3-dihydro-1H-inden-1-yl)carbamate
[1-(6-Methoxy-pyriMidin-4-yl)-piperidin-4-yl]-Methyl-aMine hydrochloride
(1R,4R)-N-(2-Fluoro-benzyl)-cyclohexane-1,4-diaMine hydrochloride
(1r,4r)-N1-(4-fluorobenzyl)cyclohexane-1,4-diamine hydrochloride
1-methyl-6-(tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indazole
TERT-BUTYL 3-AMINO-5-CYANO-1H-INDAZOLE-1-CARBOXYLATE
6-(4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLAN-2-YL)-2,3-DIHYDROINDEN-1-ONE
3-(1-BENZYL-3,5-DIMETHYL-1 H-PYRAZOL-4-YL)-PROPIONIC ACID
(3aS,6aS)-3,6-diphenyl-1,3a,4,6a-tetrahydropentalene
METHYL 4-((TERT-BUTOXYCARBONYL)AMINO)PIPERIDINE-4-CARBOXYLATE
2-(1-tert-Butoxycarbonylpiperazin-4-yl)propionic acid
n-(tert-butoxycarbonyl)-l-proline n-methoxy-n-methylamide
Propoxate
C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic
1-N-Cbz-1-N-Methyl-1,3-diaminopropane hydrochloride
2-(4-AMINO-1-(TERT-BUTOXYCARBONYL)PIPERIDIN-4-YL)ACETIC ACID
6-(2-Oxo-hexahydro-thieno[3,4-D]imidazol-4-YL)-hexanoic acid
tert-Butyl 2-(methoxy(methyl)carbamoyl)pyrrolidine-1-carboxylate
1-Methoxy-4-[(4-methoxyphenyl)methoxymethyl]benzene
Cyclopenta(c)pyrido(3,2-a)carbazole, 1,2,3,8-tetrahydro-
56684-87-8
3'-O-Methylbatatasin III shows spasmolytic activity[1]. 3'-O-Methylbatatasin III shows spasmolytic activity[1].
1,2,3,4,7,8,9,10-Octahydro[1]benzothieno[2,3-b]quinolin-11-amine
(3Z)-3-benzylidene-6-(2-methylpropyl)piperazine-2,5-dione
1,4-Dihydroxy-3,6-bis(2-methylpropyl)pyrazine-1,4-diium-2,5-diol
(5R)-6-(2-amino-1-carbamoyl-4,5-dihydroimidazol-4-yl)-5-hydroxyhexanoic acid
2-[4-[(Z)-(2-oxocyclohexylidene)methyl]phenyl]propanoic acid
N-{(E)-amino[(5-methyl-1,3-benzoxazol-2-yl)amino]methylidene}cyclopropanecarboxamide
4-tert-butylbenzaldehyde (4-amino-4H-1,2,4-triazol-3-yl)hydrazone
4-[3-[oxo(1-pyrrolidinyl)methyl]-2H-isoxazol-5-ylidene]-1-cyclohexa-2,5-dienone
Mimosifolenone
A cyclic ketone that is cyclohept-2-en-1-one substituted by a hydroxy group at position 5, a methoxy group at position 6 and a 2-phenylethenyl group at position 5 (the 5R,6R stereoisomers). Isolated from the rootwood of Aeschynomene mimosifolia, it exhibits cytotoxic towards human cancer cell lines.
Indolmycin(1+)
An organic cation obtained by protonation at position 3 in the oxazole ring of indolmycin. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).
(4-Methoxyphenyl)-(3-methyl-2-propyl-4-imidazolyl)methanone
N-[(E)-(5-hydroxy-3-methyl-1-phenyl-1H-pyrazol-4-yl)methylidene]acetohydrazide
(2E)-2-[(3-nitrophenyl)methylidene]-1-azabicyclo[2.2.2]octan-3-one
1-[5-Amino-3-(2-methylphenyl)-1,2,4-triazol-1-yl]-2,2-dimethylpropan-1-one
2-[1,3-Dihydroxypropan-2-yloxy(hydroxy)phosphoryl]oxyethyl-trimethylazanium
3-Hydroxy-1-oxo-1-[2-(2,3,4-trihydroxybenzyl)hydrazinyl]propan-2-aminium
2-[[(2S)-2,3-dihydroxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium
Methyl 2-(N-((4S)-4-(2-methylpropyl)-2-oxazolidinone-3-carbamoyl))aminoacetate
Methyl 2-(N-((4S)-4-(1,1-dimethylethyl)-2-oxazolidinone-3-carbamoyl))aminoacetate
2-(4-Methylphenyl)-4,4-dimethyltetrahydropyrrolo[3,4-c]pyrrole-1,3(2H,5H)-dione
Ethyl (4R*,5R*)-(E)-5-hydroxy-4-(2-tetrahydropyranyl)oxy-2-hexenoate
2-(((R)-2,3-Dihydroxypropyl)phosphoryloxy)-N,N,N-trimethylethanaminium
1,1-(Tetrahydro-6a-hydroxy-2,3a,5-trimethylfuro[2,3-d]-1,3-dioxole-2,5-diyl)bis-ethanone
6-Nitroquipazine
D018377 - Neurotransmitter Agents > D018490 - Serotonin Agents > D012702 - Serotonin Antagonists
3-[(2-aminoethyl)sulfanyl]-6-ethyl-7-oxo-1-azabicyclo[3.2.0]heptane-2-carboxylic acid
A beta-lactam that is 7-oxo-1-azabicyclo[3.2.0]heptane-2-carboxylic acid carrying additional (2-aminoethyl)sulfanyl and ethyl substituents at positions 3 and 6 respectively. An intermediate in the biosynthesis of carbapenem.
5-ethyl-2,8,9-trihydroxy-3,12-dioxatricyclo[6.2.2.0⁴,⁹]dodecan-10-one
5-{2-[3-(1-hydroxyethyl)oxiran-2-yl]-2-methoxyethyl}-5-methoxyfuran-2-one
2-[(2s)-4-(4-methylpent-3-en-1-yl)-2,5-dihydrofuran-2-yl]cyclohexa-2,5-diene-1,4-dione
2-methyl-4-(1,5,6-trihydroxy-4-methyl-2-oxocyclohex-3-en-1-yl)butanoic acid
(1r,2s,4s,5r,8s,9r)-5-ethyl-2,8,9-trihydroxy-3,12-dioxatricyclo[6.2.2.0⁴,⁹]dodecan-10-one
methyl (3e,5e)-2-(methoxymethylidene)-3-methyl-6-phenylhexa-3,5-dienoate
7,8-dihydroxy-4-methoxy-10-propyl-3,4,7,8,9,10-hexahydrooxecin-2-one
methyl (1s,5s)-5-[(2s)-3-hydroxy-1-methoxy-1-oxopropan-2-yl]-2-(hydroxymethyl)cyclopent-2-ene-1-carboxylate
5-hydroxy-6-[1-(c-hydroxycarbonimidoyl)-2-iminoimidazolidin-4-yl]hexanoic acid
(2r)-2-(6-methoxy-6-oxohexyl)-3-methylidenebutanedioic acid
(13e)-1-amino-13-(2-hydroxyethylidene)-11-methyl-6-azatricyclo[7.3.1.0²,⁷]trideca-2,4,6,10-tetraen-5-ol
7-methoxy-2,2-dimethyl-3h,4h-naphtho[1,2-b]pyran-3-ol
2-(6-methoxy-6-oxohexyl)-3-methylidenebutanedioic acid
1-[3-(hydroxymethyl)-9h-pyrido[3,4-b]indol-1-yl]ethane-1,2-diol
(3r,4e,6e,12e)-3-hydroxytetradeca-4,6,12-trien-8,10-diyn-1-yl acetate
(3r)-7-methoxy-2,2-dimethyl-3h,4h-naphtho[1,2-b]pyran-3-ol
6-(acetyloxy)-1,8-dihydroxyocta-3,5-dien-3-yl acetate
1-(2-hydroxyethyl)-4-methoxy-beta-carboline
{"Ingredient_id": "HBIN000880","Ingredient_name": "1-(2-hydroxyethyl)-4-methoxy-beta-carboline","Alias": "NA","Ingredient_formula": "C14H14N2O3","Ingredient_Smile": "NA","Ingredient_weight": "258.27","OB_score": "NA","CAS_id": "77369-99-4","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "9699","PubChem_id": "NA","DrugBank_id": "NA"}
1-(3,5-dihydroxy-4-methylphenyl)-2-(2-hydroxyphenyl)ethane; 2'-me ether
{"Ingredient_id": "HBIN001050","Ingredient_name": "1-(3,5-dihydroxy-4-methylphenyl)-2-(2-hydroxyphenyl)ethane; 2'-me ether","Alias": "NA","Ingredient_formula": "C16H18O3","Ingredient_Smile": "NA","Ingredient_weight": "258.31","OB_score": "NA","CAS_id": "162411-68-9","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "9690","PubChem_id": "NA","DrugBank_id": "NA"}
4-ethoxymethylphenyl-4'-hydroxybenzylether
{"Ingredient_id": "HBIN010380","Ingredient_name": "4-ethoxymethylphenyl-4'-hydroxybenzylether","Alias": "NA","Ingredient_formula": "C16H18O3","Ingredient_Smile": "CCOCC1=CC=C(C=C1)OCC2=CC=C(C=C2)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "7411","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
6β-hydroxyhuperzine a
{"Ingredient_id": "HBIN012276","Ingredient_name": "6\u03b2-hydroxyhuperzine a","Alias": "NA","Ingredient_formula": "C15H18N2O2","Ingredient_Smile": "CC=C1C2C=C(CC1(C3=C(C2O)NC(=O)C=C3)N)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10169","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
n-(1-{2-[(hydroxymethylidene)amino]-3-methylbutoxy}-3-methyl-1-oxobutan-2-yl)carboximidic acid
(5s,7s)-9-methoxy-3,5,7-trimethyl-5h,6h,7h-naphtho[2,3-b]furan-8-one
(4s)-4-hydroxy-3,5,5-trimethyl-4-[(1s,2s,3s)-1,2,3-trihydroxybutyl]cyclohex-2-en-1-one
4-[(1r)-1-[(1s)-1-(4-hydroxyphenyl)ethoxy]ethyl]phenol
3-hydroxy-8-isopropyl-7-methoxy-5-methylnaphthalene-2-carbaldehyde
1,4-dihydroxy-3,6-bis(sec-butyl)piperazine-2,5-dione
(4s)-4-hydroxy-4-[(2e)-3-(2-methoxyphenyl)prop-2-en-1-yl]cyclohex-2-en-1-one
methyl (1s,5s)-5-(3-hydroxy-1-methoxy-1-oxopropan-2-yl)-2-(hydroxymethyl)cyclopent-2-ene-1-carboxylate
(6s)-6-[(1r,2s)-1,2-dihydroxyheptyl]-4-methoxy-5,6-dihydropyran-2-one
(3s,6z)-3-[(2s)-butan-2-yl]-6-(phenylmethylidene)-3h-pyrazine-2,5-diol
(3s,4e,6e,12e)-1-hydroxytetradeca-4,6,12-trien-8,10-diyn-3-yl acetate
3a-methoxy-1,5,8-trimethyl-1h,9bh-naphtho[2,1-b]furan-2-one
(2r,3r)-3-(4-hydroxy-3,5-dimethoxyphenyl)-3-methoxypropane-1,2-diol
4-hydroxy-4-[3-(2-methoxyphenyl)prop-2-en-1-yl]cyclohex-2-en-1-one
(1r,9r,13e)-1-amino-13-(2-hydroxyethylidene)-11-methyl-6-azatricyclo[7.3.1.0²,⁷]trideca-2,4,6,10-tetraen-5-ol
{[(3e,5s)-5-hydroxy-5-(hydroxymethyl)-2-methoxy-3-(methylimino)cyclohex-1-en-1-yl]amino}acetic acid
2-{5-[(2s)-2,3-dihydroxy-3-methylbutyl]-1h-indol-3-yl}acetonitrile
3-hydroxytetradeca-4,6,12-trien-8,10-diyn-1-yl acetate
(2s,3r,4r,5r,6s)-2-[(2e,4e)-hepta-2,4-dien-1-yloxy]-6-methyloxane-3,4,5-triol
2-[5-(2,3-dihydroxy-3-methylbutyl)-1h-indol-3-yl]acetonitrile
(2r,4r,7s)-7-hydroxy-2-methyl-5,10-dioxooxecan-4-yl acetate
(2s)-1-[(5s)-5-amino-5-carboxypentyl]-5-oxopyrrolidine-2-carboxylic acid
2-{6-[(2s)-2,3-dihydroxy-3-methylbutyl]-1h-indol-3-yl}acetonitrile
(2s)-1-[(4s)-4-amino-4-carboxybutanoyl]piperidine-2-carboxylic acid
5-[2-(2-hydroxyphenyl)ethyl]-3-methoxy-2-methylphenol
2-methyl-6-[(2e,5e)-3-methyl-7-oxoocta-2,5-dien-1-yl]cyclohexa-2,5-diene-1,4-dione
5-(6-hydroxy-2-methylchromen-2-yl)-2-methylpent-2-enal
(1s,2r,3r)-2,8-dihydroxy-1,3-dimethyl-2,3,4,10-tetrahydro-1h-anthracen-9-one
1-[6-methoxy-5-(3-methylbut-2-en-1-yl)-1-benzofuran-2-yl]ethanone
(3s,9ar)-3-benzyl-1-hydroxy-3h,6h,7h,8h,9h,9ah-pyrido[1,2-a]pyrazin-4-one
6-(1,2-dihydroxyheptyl)-4-methoxy-5,6-dihydropyran-2-one
(3as,6ar,8s,9ar,9bs)-3,6,9-trimethylidene-2-oxo-octahydroazuleno[4,5-b]furan-8-carbaldehyde
2-phenylethyl 3-(3-oxocyclopent-1-en-1-yl)propanoate
9-methoxy-3,5,7-trimethyl-5h,6h,7h-naphtho[2,3-b]furan-8-one
(2e)-5-[(2s)-6-hydroxy-2-methylchromen-2-yl]-2-methylpent-2-enal
(1r,9s,10r,12s,14z)-1-amino-14-ethylidene-12-methyl-11-oxa-6-azatetracyclo[7.4.1.0²,⁷.0¹⁰,¹²]tetradeca-2,4,6-trien-5-ol
5-[2-(2-methoxyphenyl)ethyl]-2-methylbenzene-1,3-diol
methyl (1s,5r)-5-[(2s)-3-hydroxy-1-methoxy-1-oxopropan-2-yl]-2-(hydroxymethyl)cyclopent-2-ene-1-carboxylate
2-{6-[(2r)-2,3-dihydroxy-3-methylbutyl]-1h-indol-3-yl}acetonitrile
3-benzyl-1-hydroxy-3h,6h,7h,8h,9h,9ah-pyrido[1,2-a]pyrazin-4-one
(3s,6s)-3,6-bis[(2r)-butan-2-yl]-1,4-dihydroxypiperazine-2,5-dione
4-hydroxy-3-methoxy-6-(1-phenylprop-2-en-1-yl)cyclohex-2-en-1-one
3-(4-hydroxy-3,5-dimethoxyphenyl)-3-methoxypropane-1,2-diol
1-hydroxytetradeca-4,6,12-trien-8,10-diyn-3-yl acetate
2-[(4-amino-4-carboxy-1-hydroxybutylidene)amino]-3-methylidenepentanoic acid
9-methoxy-3,5-dimethyl-5h,6h,7h,8h-naphtho[2,3-b]furan-4-carbaldehyde
(2s,3s)-1-(4-hydroxyphenyl)-4-phenylbutane-2,3-diol
7-methoxy-2-methyl-6-(3-methylbut-2-en-1-yl)chromen-4-one
methyl 2-(methoxymethylidene)-3-methyl-6-phenylhexa-3,5-dienoate
2-[4-(4-methylpent-3-en-1-yl)furan-2-yl]benzene-1,4-diol
n-[(2r)-1-[(2r)-2-[(hydroxymethylidene)amino]-3-methylbutoxy]-3-methyl-1-oxobutan-2-yl]carboximidic acid
(2r)-2-methyl-4-[(1s,5r,6r)-1,5,6-trihydroxy-4-methyl-2-oxocyclohex-3-en-1-yl]butanoic acid
(1r,3s)-9-methoxy-1,3-dimethyl-1h,3h,4h-naphtho[2,3-c]pyran-10-ol
(4r,6s)-4-hydroxy-3-methoxy-6-[(1s)-1-phenylprop-2-en-1-yl]cyclohex-2-en-1-one
methyl 7-acetyl-2,3-dihydroxy-8-methyl-6-oxabicyclo[3.2.1]octane-1-carboxylate
1-methoxy-2-{[(2-methoxyphenyl)methoxy]methyl}benzene
methyl (1r,2s,3s,5s,8s)-7-acetyl-2,3-dihydroxy-8-methyl-6-oxabicyclo[3.2.1]octane-1-carboxylate
(2r,3r,4s,5s,6r)-2-[(2e,4z)-hepta-2,4-dien-1-yloxy]-6-methyloxane-3,4,5-triol
(4s,5e,7s,8s,10r)-7,8-dihydroxy-4-methoxy-10-propyl-3,4,7,8,9,10-hexahydrooxecin-2-one
(2e)-3-(2,2-dimethylchromen-6-yl)prop-2-en-1-yl acetate
(1r,8r,9r,13e)-1-amino-13-ethylidene-11-methyl-6-azatricyclo[7.3.1.0²,⁷]trideca-2,4,6,10-tetraene-5,8-diol
(2e)-5-(6-hydroxy-2-methylchromen-2-yl)-2-methylpent-2-enal
(5r)-5-hydroxy-6-[(4r)-1-(c-hydroxycarbonimidoyl)-2-iminoimidazolidin-4-yl]hexanoic acid
4-hydroxy-3-[(3-methylimidazol-4-yl)methyl]-1-phenylbutan-1-one
(5s)-9-methoxy-3,5-dimethyl-5h,6h,7h,8h-naphtho[2,3-b]furan-4-carbaldehyde
(3e,5e)-6-(acetyloxy)-1,8-dihydroxyocta-3,5-dien-3-yl acetate
(7s,8r,9r)-9-(hydroxymethyl)-4,7-dimethoxy-7,8-dimethyl-1,6-dioxaspiro[4.4]non-3-en-2-one
2-methyl-6-(3-methyl-7-oxoocta-2,5-dien-1-yl)cyclohexa-2,5-diene-1,4-dione
(1r,2r,3s,5r,6r,8r,10r)-5,6,8,10-tetramethyl-7,9,11-trioxatetracyclo[6.3.0.0²,⁶.0³,¹⁰]undecane-1,3,5-triol
4-hydroxy-3-methoxy-4-(3-phenylprop-2-en-1-yl)cyclohex-2-en-1-one
(e)-n-[(4,5-dimethoxy-6-phenylpyridin-2-yl)methylidene]hydroxylamine
(4s)-4-hydroxy-3-methoxy-4-[(2e)-3-phenylprop-2-en-1-yl]cyclohex-2-en-1-one
3-(phenylmethylidene)-6-(sec-butyl)-6h-pyrazine-2,5-diol
2-{[(1s)-2,3-dimethyl-5-methylidene-4-oxocyclopent-2-en-1-yl]methyl}-4,5-dimethylcyclopent-4-ene-1,3-dione
3-(2,2-dimethylchromen-6-yl)prop-2-en-1-yl acetate
9-methoxy-1,3-dimethyl-1h,3h,4h-naphtho[2,3-c]pyran-10-ol
(5r)-5-[(2s)-2-[(2r,3s)-3-[(1s)-1-hydroxyethyl]oxiran-2-yl]-2-methoxyethyl]-5-methoxyfuran-2-one
2-[(2,3-dimethyl-5-methylidene-4-oxocyclopent-2-en-1-yl)methyl]-4,5-dimethylcyclopent-4-ene-1,3-dione
3-methoxy-2,3-dimethylpyrazino[1,2-a]indole-1,4-dione
(1s,3ar,9br)-3a-methoxy-1,5,8-trimethyl-1h,9bh-naphtho[2,1-b]furan-2-one
(1r)-1-{4-methoxy-9h-pyrido[3,4-b]indol-1-yl}ethane-1,2-diol
2-methoxy-5-(3-methyl-2,3-dihydro-1-benzofuran-2-yl)cyclohexa-1,5-dien-1-ol
1-(2,6-dimethylphenyl)-2-propylpyridazine-3,6-dione
n-[(2s)-1-[(2s)-2-[(hydroxymethylidene)amino]-3-methylbutoxy]-3-methyl-1-oxobutan-2-yl]carboximidic acid
2-(2-hydroxypropan-2-yl)-6-(3-methylbut-3-en-1-yn-1-yl)-2,3-dihydro-1-benzofuran-5-ol
(5e,7s)-5-ethylidene-11-methoxy-3,9-diazatricyclo[8.4.0.0³,⁷]tetradeca-1(14),10,12-trien-2-one
2-(hepta-2,4-dien-1-yloxy)-6-methyloxane-3,4,5-triol
{[(5s)-5-hydroxy-5-(hydroxymethyl)-2-methoxy-3-(methylimino)cyclohex-1-en-1-yl]amino}acetic acid
3,6,9-trimethylidene-2-oxo-octahydroazuleno[4,5-b]furan-8-carbaldehyde
(1r,9r,13r)-1-amino-13-ethenyl-11-(hydroxymethyl)-6-azatricyclo[7.3.1.0²,⁷]trideca-2,4,6,10-tetraen-5-ol
(2s,3r,4r,5r,6s)-2-[(2e,4z)-hepta-2,4-dien-1-yloxy]-6-methyloxane-3,4,5-triol
methyl 5-(3-hydroxy-1-methoxy-1-oxopropan-2-yl)-2-(hydroxymethyl)cyclopent-2-ene-1-carboxylate
(2s)-2-{[(4s)-4-amino-4-carboxy-1-hydroxybutylidene]amino}-3-methylidenepentanoic acid
9-(hydroxymethyl)-4,7-dimethoxy-7,8-dimethyl-1,6-dioxaspiro[4.4]non-3-en-2-one
6-methoxy-3-methyl-5-(3-methylbut-2-en-1-yl)isochromen-1-one
methyl (2e,3e,5e)-2-(methoxymethylidene)-3-methyl-6-phenylhexa-3,5-dienoate
8-hydroxy-4-isopropyl-2-methoxy-6-methylnaphthalene-1-carbaldehyde
1-amino-13-ethenyl-11-(hydroxymethyl)-6-azatricyclo[7.3.1.0²,⁷]trideca-2,4,6,10-tetraen-5-ol
2-methoxy-5-[(2s,3s)-3-methyl-2,3-dihydro-1-benzofuran-2-yl]cyclohexa-1,5-dien-1-ol
6-[(4-hydroxyphenyl)methyl]-3-(2-methylpropyl)-1h-pyrazin-2-one
2,8-dihydroxy-1,3-dimethyl-2,3,4,10-tetrahydro-1h-anthracen-9-one
7-isopropyl-6-methoxy-10-methyl-2-oxatricyclo[6.3.1.0⁴,¹²]dodeca-1(12),4,6,8,10-pentaen-5-ol
Nesteretal A
Nesteretal A is a furofuran. Nesteretal A has been reported in Nesterenkonia halobia with data available.