Exact Mass: 228.0998

Chrysene

1,2,5,6-Dibenzonaphthalene

Chrysene is a high molecular weight (HMW), polycyclic aromatic hydrocarbon (PAH) known for its recalcitrance and carcinogenic properties[1]. Chrysene is a high molecular weight (HMW), polycyclic aromatic hydrocarbon (PAH) known for its recalcitrance and carcinogenic properties[1].

3,4-Benzphenanthrene

D009676 - Noxae > D009153 - Mutagens

Acepyrene

3,4-Dihydrocyclopenta[cd]pyrene

TRIPHENYLENE

(1R,10aS)-1,4,10,10a-Tetrahydrophenazine-1-carboxylate

(1R,10aS)-1,4,10,10a-tetrahydrophenazine-1-carboxylic acid

(1R)-1,4,5,10-Tetrahydrophenazine-1-carboxylate

(1R)-1,4,5,10-tetrahydrophenazine-1-carboxylic acid

tebuthiuron

Pesticide2_Tebuthiuron_C9H16N4OS_Urea, N-[5-(1,1-dimethylethyl)-1,3,4-thiadiazol-2-yl]-N,N-dimethyl-

CONFIDENCE standard compound; INTERNAL_ID 557; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8138; ORIGINAL_PRECURSOR_SCAN_NO 8136 DATA_PROCESSING MERGING RMBmix ver. 0.2.7; CONFIDENCE standard compound; INTERNAL_ID 557; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8086; ORIGINAL_PRECURSOR_SCAN_NO 8082 CONFIDENCE standard compound; INTERNAL_ID 557; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8083; ORIGINAL_PRECURSOR_SCAN_NO 8081 CONFIDENCE standard compound; INTERNAL_ID 557; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8128; ORIGINAL_PRECURSOR_SCAN_NO 8126 CONFIDENCE standard compound; INTERNAL_ID 557; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8086; ORIGINAL_PRECURSOR_SCAN_NO 8082 CONFIDENCE standard compound; INTERNAL_ID 557; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8040; ORIGINAL_PRECURSOR_SCAN_NO 8038 CONFIDENCE standard compound; INTERNAL_ID 557; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 8135; ORIGINAL_PRECURSOR_SCAN_NO 8134

Chrysene

Chrysene, certified reference material, TraceCERT(R)

Chrysene appears as a crystalline solid. Denser than water and insoluble in water. The primary hazard is the threat to the environment. Immediate steps should be taken to limit spread to the environment. Toxic by ingestion. Used to make other chemicals. Chrysene is an ortho-fused polycyclic arene found commonly in the coal tar. It has a role as a plant metabolite. Chrysene is a natural product found in Camellia sinensis with data available. Chrysene is an aromatic hydrocarbon in coal tar, allied to naphthalene and anthracene. It is a white crystalline substance, C18H12, of strong blue fluorescence, but generally colored yellow by impurities. Chrysene is one of over 100 different polycyclic aromatic hydrocarbons (PAHs). PAHs are chemicals that are formed during the incomplete burning of organic substances, such as fossil fuels. They are usually found as a mixture containing two or more of these compounds. (L10) An ortho-fused polycyclic arene found commonly in the coal tar. Chrysene is a high molecular weight (HMW), polycyclic aromatic hydrocarbon (PAH) known for its recalcitrance and carcinogenic properties[1]. Chrysene is a high molecular weight (HMW), polycyclic aromatic hydrocarbon (PAH) known for its recalcitrance and carcinogenic properties[1].

Propyl propane thiosulfonate

1,3-Dimethyl 2-(3-oxocyclohexyl)propanedioic acid

Propyl propane thiosulfonate is used as a food additive [EAFUS] ("EAFUS: Everything Added to Food in the United States. [http://www.eafus.com/]") It is used as a food additive .

3-[4-(1-Imidazolylmethyl)phenyl]-2-propenoic acid

3-{4-[(1H-imidazol-1-yl)methyl]phenyl}prop-2-enoic acid

5-(Hexahydro-2-oxo-1H-thieno[3,4-D]imidazol-6-YL)pentanal

5-[(2-Oxohexahydro-1H-thieno[3,4-d]imidazole)-4-yl]pentanal

3-Hydroxyamino-4,6-dimethyldipyrido(1,2-a:3',2'-d)imidazole

6,10-dimethyl-5-nitroso-1,3,8-triazatricyclo[7.4.0.0^{2,7}]trideca-2(7),5,8,10,12-pentaene

D018501 - Antirheumatic Agents > D000894 - Anti-Inflammatory Agents, Non-Steroidal > D016861 - Cyclooxygenase Inhibitors D018373 - Peripheral Nervous System Agents > D018689 - Sensory System Agents D002491 - Central Nervous System Agents > D000700 - Analgesics D000893 - Anti-Inflammatory Agents D004791 - Enzyme Inhibitors

Glycerol 1,2-dimethacrylate

1-hydroxy-3-[(2-methylprop-2-enoyl)oxy]propan-2-yl 2-methylprop-2-enoate

Thiobutabarbital

5-(butan-2-yl)-5-ethyl-4,6-dihydroxy-2,5-dihydropyrimidine-2-thione

Loganetin

Cyclopenta[c]pyran-4-carboxylic acid, 1,4a,5,6,7,7a-hexahydro-1,6-dihydroxy-7-methyl-, methyl ester, (1R,4aS,6S,7R,7aS)-

Loganetin is an iridoid monoterpenoid that is methyl (4aS,7aR)-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate substituted at positions 1 and 6 by hydroxy groups and at postion 7 by a methyl group; the aglycone of loganin. It has a role as a plant metabolite and an antibacterial agent. It is a methyl ester, an iridoid monoterpenoid, a lactol, a cyclopentapyran, an enoate ester and a secondary alcohol. Loganetin is a natural product found in Scaevola floribunda, Calycophyllum spruceanum, and other organisms with data available. An iridoid monoterpenoid that is methyl (4aS,7aR)-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate substituted at positions 1 and 6 by hydroxy groups and at postion 7 by a methyl group; the aglycone of loganin. Loganetin is a non-toxic natural product that may be applied in the antibacterial agent development for treating multidrug-resistant Gram negative infections.

Aaptamine

11,12-dimethoxy-2,6-diazatricyclo[7.3.1.05,13]trideca-1,3,5(13),7,9,11-hexaene

Aaptamine is a natural product found in Aaptos, Aaptos aaptos, and other organisms with data available.

Xanthocidin

(+)-cyclopentanecarboxylic acid

FT-0776897

Isoaaptamine

3-O-Methylpaeonisuffral

(+)-3-O-Methylpaeonisuffral

A member of the class of 4-pyridones that is 4-pyridone in which the hydrogens at positions 3 and 6 have been replaced by aminocarbonyl and benzyl groups, respectively. It has been isolated from the Cynodon dactylon-associated endophytic fungus Cladosporium herbarum IFB-E002 and from a sponge-derived Aspergillus niger.

Chlamydospordiol

6-(3-Hydroxy-2-butanyl)-5-(hydroxymethyl)-4-methoxy-2H-pyran-2-one

2-Methyl-5-(1-methylindanyl)-thiophen

C15H16S (228.0973)

3,3-biindenyl

(3S,4R,5R,7S,8S,9S)-8,11-epoxy-7-hydroxy-3-methoxydihyronepetalactone|jatamanin I

1-Hydroxy-6-isopropyl-3-[2-(methylthio)-ethyl]-2(1H)-pyazinone

jatamanin L

2,3-Dimethoxy-5-(2,3-dihydroxypropyl)phenol

(1R,4S,4aS,7aS)-4,7-Dihydroxymethyl-1-methoxyl-1,4,4a,7a-tetrahydrocyclopenta-6-ene[e]pyran-3-one|1beta-methoxygardendiol

anthocleistenolide

(2E)-4-methoxy-2-(nitrosomethylidene)-6-phenyl-1H-pyridine

rel-(2S,3R)-3-(3-hydroxy-5-methoxyphenyl)-3-methoxypropane-1,2-diol

SCHEMBL15240937

Cyclo-Met-Pro-diketopiperazine

Veratryl glycerol

alatusol D

massarilactone B

pimprinol A

liguhodgcins B

(2S)-4-(2,2-dimethyl-5-oxotetrahydrofuran-3-yl)-2-hydroxypent-3-anoic acid|dasycarpus acid

sinularone G

dihydro-3-hydroxy-4-(hydroxymethyl)-3-(1-hydroxy-hexa-2,4-dien-1-yl)-2(3H)-furanone

Agistatine E

1-beta-Hydroxydihydrocornin aglycone/ 1alpha-Hydroxydihydrocornin aglycone

C11H16O5

CHEMBL455756

decarestrictine E

CHEMBL463757

3-(4-Hydroxy-3,5-dimethoxyphenyl)-1,2-propanediol

Altibiotic LL-P880gammar

Picrasidine P

SCHEMBL6741819

Harmine N-oxide

Ozagrel

3-[4-(1H-imidazol-1-ylmethyl)phenyl]-2E-propenoic acid

D018377 - Neurotransmitter Agents > D018494 - Histamine Agents > D006633 - Histamine Antagonists C78275 - Agent Affecting Blood or Body Fluid > C1327 - Antiplatelet Agent D006401 - Hematologic Agents > D005343 - Fibrinolytic Agents D050299 - Fibrin Modulating Agents D002317 - Cardiovascular Agents D004791 - Enzyme Inhibitors C471 - Enzyme Inhibitor

6-[(1S,2R)-1,2-dihydroxypentyl]-4-methoxypyran-2-one

NCGC00384874-01!6-[(1S,2R)-1,2-dihydroxypentyl]-4-methoxypyran-2-one

6-(3-hydroxybutan-2-yl)-5-(hydroxymethyl)-4-methoxypyran-2-one

NCGC00179979-02!6-(3-hydroxybutan-2-yl)-5-(hydroxymethyl)-4-methoxypyran-2-one

6-benzyl-4-oxo-1H-pyridine-3-carboxamide

NCGC00380293-01!6-benzyl-4-oxo-1H-pyridine-3-carboxamide

C11H16O5

NCGC00381200-01_C11H16O5_

cyclo(methionylpropyl)

Origin: Microbe

6-[(1S,2R)-1,2-dihydroxypentyl]-4-methoxypyran-2-one [IIN-based on: CCMSLIB00000845037]

NCGC00384874-01!6-[(1S,2R)-1,2-dihydroxypentyl]-4-methoxypyran-2-one [IIN-based on: CCMSLIB00000845037]

6-[(1S,2R)-1,2-dihydroxypentyl]-4-methoxypyran-2-one [IIN-based: Match]

NCGC00384874-01!6-[(1S,2R)-1,2-dihydroxypentyl]-4-methoxypyran-2-one [IIN-based: Match]

chlamydospordiol_9.5\\%

chlamydospordiol_major

chlamydospordiol_5.5\\%

Depdecin

(2R,3S,4S,5E,7S,8S,9R)-2,9-dihydroxy-3,4,7,8-diepoxy-undeca-5,10-diene

A polyketide that is depudecin with a methyl hydrogen substituted with a hydroxy group.

CAY10512

1-fluoro-2-[2-(4-methoxyphenyl)ethenyl]-benzene

C15H13FO (228.095)

dimethyl 2-(3-oxocyclohexyl)propanedioate

2-(3-OXO-CYCLOHEXYL)-MALONIC ACID DIMETHYL ESTER

FA 11:3;O3

8-oxo-3S-carboxy-2-methylidenenonanoic acid

M-TOLYL-PHOSPHONIC ACID DIETHYL ESTER

Diphenyl(propyl)phosphine

C15H17P (228.1068)

Isopropyl(diphenyl)phosphine

C15H17P (228.1068)

Phosphorous acid,diethyl phenylmethyl ester

5-Pyrimidinecarboxylicacid,1,2,3,4-tetrahydro-6-methyl-4-(1-methylethyl)-2-thioxo-,methylester(9CI)

DL-ARGININE HYDROCHLORIDE MONOHYDRATE

C6H17ClN4O3 (228.0989)

(4-(PHENOXYMETHYL)PHENYL)BORONIC ACID

3-(3-aminophenyl)-N,N-dimethylpropanamide(SALTDATA: 2HCl)

(S)-4,5-ISOPROPYLIDENEHEXANONITRILE

6-(2-AMINO-PHENYL)-NICOTINIC ACID METHYL ESTER

3-Phenoxybenzhydrazide

2-Phenoxybenzhydrazide

Glycerol 1,3-dimethacrylate

Benzenepropanoic acid, a,b-dicyano-, ethyl ester

N-(2-Methoxyphenyl)isonicotinamide

3-Pyridinecarboxamide,N-(2-methoxyphenyl)-

N-(2-METHOXYPHENYL)PICOLINAMIDE

4-oxo-8-propan-2-yloxy-1H-quinoline-3-carbonitrile

methyl 3-(6-aminopyridin-3-yl)benzoate

Benzyl 6-aminonicotinate

Methyl 1-(1-Methoxy-1,3-dioxopropan-2-yl)cyclopentane-1-carboxyl

Urea, N-(1,1-dimethylethyl)-N-(5-ethyl-1,3,4-thiadiazol-2-yl)- (9CI)

4-Benzyloxy-butyramidine HCl

3-Amino-2-(phenylamino)benzoic acid

ethyl-4-phenyl pyrimidine-5-carboxylate

4-(aminomethyl)piperidineinformamidine dihydrochloride

C7H18Cl2N4 (228.0908)

2-[2-(2,4-difluorophenyl)-2-propen-1-yl]-1,3-propanediol

C12H14F2O2 (228.0962)

3-amino-N-(tert-butyl)benzenesulfonamide

2-PHENYL-2-PIPERIDIN-1-YL-ETHYLAMINE

3,4,5-trimethoxyphenylacetic-2,2-d2 acid

C11H12D2O5 (228.0967)

1-(4-METHOXYPHENYL)PIPERAZINEHYDROCHLORIDE

ethyl 8-oxo-1,4-dioxaspiro[4.5]decane-7-carboxylate

(4-Methoxy-[1,1-biphenyl]-4-yl)boronic acid

3-Pyridazinecarboxamide, 6-[(phenylmethyl)amino]

Benzaldehyde, 3-(ethenyloxy)-4-(4-methyl-1H-imidazol-1-yl)

5-Methoxy-N-phenylnicotinamide

Tocainide hydrochloride

D002317 - Cardiovascular Agents > D026941 - Sodium Channel Blockers > D061567 - Voltage-Gated Sodium Channel Blockers C78274 - Agent Affecting Cardiovascular System > C47793 - Antiarrhythmic Agent D002317 - Cardiovascular Agents > D000889 - Anti-Arrhythmia Agents D049990 - Membrane Transport Modulators C93038 - Cation Channel Blocker

N-benzyl-4-nitroaniline

1-(4-Methoxyphenyl)piperazine hydrochloride (1:1)

3-METHYL-4-NITRO-BIPHENYL-2-YLAMINE

1-(2-Methoxyphenyl)piperazine hydrochloride

4-amino-N-tert-butylbenzenesulfonamide

Methyl 5-methyl-2-(pyrimidin-2-yl)benzoate

1-hydroxy-2-phenyl-6,7-dihydro-5H-benzimidazol-4-one

1-hydroxy-2-phenyl-1,5,6,7-tetrahydro-4H-benzimidazol-4-one

4-PYRIMIDIN-5-YL-BENZOIC ACID ETHYL ESTER

4-Amino-N,N-diethylbenzenesulfonamide

Diethyl benzylphosphonate

5-amino-1-(3-ethoxyphenyl)pyrazole-4-carbonitrile

2-AMINO-N-MESITYLACETAMIDE HYDROCHLORIDE

PHENOL, 4-AMINO-, 1-(4-AMINOBENZOATE)

2-Amino-N,N-diethylbenzenesulfonamide

2-(5-CHLOROPENT-1-YN-1-YL)-4,4,5,5-TETRAMETHYL-1,3,2-DIOXABOROLANE

C11H18BClO2 (228.1088)

CARBAMIC ACID, 2-PYRIDINYL-, PHENYLMETHYL ESTER

2-(4-Fluorophenyl)-1-p-tolyl-ethanone

C15H13FO (228.095)

3-amino-n-butylbenzenesulfonamide

Phenol,4-[2-(4-methoxyphenyl)diazenyl]-

1-phenyl-5,6-dihydro-4H-cyclopenta[c]pyrazole-3-carboxylic acid

N-Benzyl-2-nitroaniline

(3-(Benzyloxy)phenyl)boronic acid

3-(aminomethyl)-N-propylbenzenesulfonamide

3-(2-methyl-1H-indol-3-yl)pyrrolidine-2,5-dione

4-[(Pyridin-4-ylmethyl)-amino]-benzoic acid

3-AMINO-4-PHENYLAMINO-BENZOIC ACID

CHEMPACIFIC 39976

N-(3-aminopropyl)-4-methylbenzenesulfonamide

2-Amino-N-butylbenzenesulfonamide

Tetracene

Naphthacene

(3-METHOXY-[1,1-BIPHENYL]-4-YL)BORONIC ACID

methyl 3-(3-aminophenyl)pyridine-4-carboxylate

diethyl 4-oxo-1,2-cyclopentanedicarboxylate

2-[5-(1,2,4-triazol-4-yl)-1H-indol-3-yl]ethanol

2-(4-methylphenoxy)pyridine-3-carboxamide

4-Phenoxybenzhydrazide

Thiobutabarbital

4,6(1H,5H)-Pyrimidinedione,5-ethyldihydro-5-(1-methylpropyl)-2-thioxo-

C78272 - Agent Affecting Nervous System > C29756 - Sedative and Hypnotic > C67084 - Barbiturate

Acetamide,2-phenoxy-N-3-pyridinyl-

2-Amino-N,N-dimethyl-3-phenylpropanamidehydrochloride

Diethyl 3,6-dihydro-2H-pyran-2,2-dicarboxylate

Thiourea, N-cyclopropyl-N-(3-ethyl-2-oxo-1-imidazolidinyl)- (9CI)

N-(2,6-dimethylphenyl)-2-(methylamino)acetamide,hydrochloride

4-(2-fluorophenyl)propiophenone

C15H13FO (228.095)

TERT-BUTYL (2-AMINOTHIOPHEN-3-YL)METHYLCARBAMATE

4-(4-OXO-PIPERIDINE-1-CARBONYL)-BENZONITRILE

H-DL-Arg-OH.HCl

C6H17ClN4O3 (228.0989)

(4-(Benzyloxy)phenyl)boronic acid

ETHYL 1-(CYANOMETHYL)-1H-INDOLE-2-CARBOXYLATE

2-(benzylamino)nicotinic acid

SODIUM METHOXY PPG-2 ACETATE

C9H17NaO5 (228.0974)

4-DIMETHOXYMETHYL-2-PROPYLSULFANYL-PYRIMIDINE

1-ethenylpyrene

Mesityl phenyl sulfide

C15H16S (228.0973)

P-TOLYL-PHOSPHONIC ACID DIETHYL ESTER

4-(1-Hydroxy-1-phenyl)methylphenylboronic acid

4-METHYL-2-PHENYL-5-PYRIMIDINECARBOHYDRAZIDE

3-Amino-N,N-diethylbenzenesulfonamide

TYCOR (TM)

(3aR,5S,6S,6aR)-6-[[(3aR,5S,6S,6aR)-6-hydroxyspiro[3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole-2,1-cyclohexane]-5-yl]-hydroxymethoxy]spiro[3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole-2,1-cyclohexane]-5-carbaldehyde

(3aR,5S,6S,6aR)-6-[[(3aR,5S,6S,6aR)-6-hydroxyspiro[3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole-2,1-cyclohexane]-5-yl]-hydroxymethoxy]spiro[3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxole-2,1-cyclohexane]-5-carbaldehyde

3-(aminomethyl)-N-propan-2-ylbenzenesulfonamide

(2-(Benzyloxy)phenyl)boronic acid

2-Chloro-1,4-di-n-propoxybenzene

C12H17ClO2 (228.0917)

N-(4-Aminophenyl)-2-hydroxybenzamide

6-Benzyl-4-oxo-1,4-dihydropyridine-3-carboxamide

(E)-4-methoxy-2-phenylpyridine-6-carbaldehyde oxime

Fenpentadiol

C12H17ClO2 (228.0917)

C78272 - Agent Affecting Nervous System > C265 - Antidepressant Agent

3-Imino-1,5,5-trimethyl-2-oxabicyclo[2.2.1]heptane-4,7,7-tricarbonitrile

2-methoxy-N-(2-pyridinyl)benzamide

2-(Pyridin-4-ylmethylamino)benzoic acid

N-[(E)-(4-methylphenyl)methylideneamino]furan-2-carboxamide

Pleiadene

N-(3-pyridinylmethyl)-1,3-benzodioxol-5-amine

(1S,2R)-LL-P880gamma

(3S,8aS)-3-(2-methylsulfanylethyl)-2,3,6,7,8,8a-hexahydropyrrolo[1,2-a]pyrazine-1,4-dione

1H-Indole-3-acetonitrile, 1-(trimethylsilyl)-

C13H16N2Si (228.1083)

(2S)-2-Amino-4-(methylsulfanyl)-1-pyridin-2-ylbutane-1,1-diol

5-(Hexahydro-2-oxo-1H-thieno[3,4-D]imidazol-6-YL)pentanal

methyl (2S)-3-(1H-indol-3-yl)-2-isocyanopropanoate

3-(2,4-dimethyl-6-oxo-3H-pyran-2-yl)-2-hydroxy-2-methylpropanoic acid

N-(5-methyl-3-isoxazolyl)-3-phenylacrylamide

N-(3,4-dihydro-2H-pyrrol-5-yl)-5-phenyl-1,3,4-oxadiazol-2-amine

3-Benzylamino-2-cyanomethyl-2-buten-4-olide

Benzo[c]phenanthrene

D009676 - Noxae > D009153 - Mutagens

3,4-Dihydrocyclopenta(cd)pyrene

(1R,10aS)-1,4,10,10a-tetrahydrophenazine-1-carboxylic acid

A member of the class of phenazines that is 1,4,10,10a-tetrahydrophenazine substituted at position 1 by a carboxy group (the 1R,10aS-diastereomer).

(1R)-1,4,5,10-tetrahydrophenazine-1-carboxylic acid

Benz[a]anthracene

1,2-Benzanthracene

caerulomycin K

A pyridine alkaloid that is 2-phenylpyridine substituted by a methoxy group at position 4 and a (E)-(hydroxyimino)methyl group at position 6. Isolated from the marine-derived actinomycete Actinoalloteichus cyanogriseus, it exhibits antineoplastic activity.

Cyclo(Met-Pro)

6-benzyl-4-oxo-1h-pyridine-3-carboximidic acid

6-[(1r,3r)-1,3-dihydroxypentyl]-4-methoxypyran-2-one

5-[(1r,2s)-1,2-dihydroxybutyl]-4-methoxy-6-methylpyran-2-one

2,12-dimethoxy-7,11-diazatricyclo[6.4.1.0⁴,¹³]trideca-1,3,5,8(13),9,11-hexaene

4,6,7-trihydroxy-10-methyl-3-methylidene-2-oxaspiro[4.5]decan-1-one

6-(1,5-dihydroxypentyl)-4-methoxypyran-2-one

(2s)-3-(4-hydroxy-3,5-dimethoxyphenyl)propane-1,2-diol

3-(2,6-dimethoxyoxan-4-yl)-5h-furan-2-one

(1r,4r,4as,7as)-4,7-dihydroxymethyl-1-methoxyl-1,4,4a,7a-tetrahydrocyclopenta-6-ene[e]pyran-3-one

{"Ingredient_id": "HBIN003123","Ingredient_name": "(1r,4r,4as,7as)-4,7-dihydroxymethyl-1-methoxyl-1,4,4a,7a-tetrahydrocyclopenta-6-ene[e]pyran-3-one","Alias": "NA","Ingredient_formula": "C11H16O5","Ingredient_Smile": "COC1C2C(CC=C2CO)C(C(=O)O1)CO","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "6037","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

(1r,4s,4as,7as)-4,7-dihydroxymethyl-1-methoxyl-1,4,4a,7a-tetrahydrocyclopenta-6-ene[e]pyran-3-one