Exact Mass: 314.1338

D011838 - Radiation-Sensitizing Agents > D017319 - Photosensitizing Agents > D011564 - Furocoumarins

2,3-Didehydrogibberellin A9

2,3-Dehydro-gibberellin A9; 2,3-Didehydro-gibberellin A9

KEIO_ID R041; [MS2] KO009222 KEIO_ID R041; [MS3] KO009225 KEIO_ID R041; [MS3] KO009224 KEIO_ID R041

Ratic

Ranitidine

A - Alimentary tract and metabolism > A02 - Drugs for acid related disorders > A02B - Drugs for peptic ulcer and gastro-oesophageal reflux disease (gord) > A02BA - H₂-receptor antagonists D018377 - Neurotransmitter Agents > D018494 - Histamine Agents > D006633 - Histamine Antagonists D005765 - Gastrointestinal Agents > D000897 - Anti-Ulcer Agents CONFIDENCE standard compound; INTERNAL_ID 414; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 1945; ORIGINAL_PRECURSOR_SCAN_NO 1942 CONFIDENCE standard compound; INTERNAL_ID 414; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 1940; ORIGINAL_PRECURSOR_SCAN_NO 1938 CONFIDENCE standard compound; INTERNAL_ID 414; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 1950; ORIGINAL_PRECURSOR_SCAN_NO 1947 CONFIDENCE standard compound; INTERNAL_ID 414; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 1935; ORIGINAL_PRECURSOR_SCAN_NO 1932 CONFIDENCE standard compound; INTERNAL_ID 414; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 1990; ORIGINAL_PRECURSOR_SCAN_NO 1987 CONFIDENCE standard compound; INTERNAL_ID 414; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 1943; ORIGINAL_PRECURSOR_SCAN_NO 1940 CONFIDENCE standard compound; INTERNAL_ID 414; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4078; ORIGINAL_PRECURSOR_SCAN_NO 4074 CONFIDENCE standard compound; INTERNAL_ID 414; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4083; ORIGINAL_PRECURSOR_SCAN_NO 4078 CONFIDENCE standard compound; INTERNAL_ID 414; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4111; ORIGINAL_PRECURSOR_SCAN_NO 4107 CONFIDENCE standard compound; INTERNAL_ID 414; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4113; ORIGINAL_PRECURSOR_SCAN_NO 4111 CONFIDENCE standard compound; INTERNAL_ID 414; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 4107; ORIGINAL_PRECURSOR_SCAN_NO 4106 CONFIDENCE standard compound; INTERNAL_ID 4121 INTERNAL_ID 4121; CONFIDENCE standard compound CONFIDENCE standard compound; INTERNAL_ID 1115 INTERNAL_ID 1115; CONFIDENCE standard compound

(R)-3-(METHYLAMINO)-1-PHENYLPROPANOLHYDROCHLORIDE

1-(2-Hydroxy-3-methylnaphthalen-1-yl)-3-methylnaphthalen-2-ol

Ranitidine

dimethyl[(5-{[(2-{[(E)-1-(methylamino)-2-nitroethenyl]amino}ethyl)sulfanyl]methyl}furan-2-yl)methyl]amine

Ranitidine (CAS: 66357-35-5) is a non-imidazole blocker of histamine receptors that mediate gastric secretion (H2 receptors). It is used to treat gastrointestinal ulcers (PubChem). Ranitidine is a histamine H2-receptor antagonist that inhibits stomach acid production and is commonly used in the treatment of peptic ulcer disease (PUD) and gastroesophageal reflux disease (GERD). It is currently marketed by GlaxoSmithKline under the trade name Zantac (Wikipedia). A non-imidazole blocker of those histamine receptors that mediate gastric secretion (H2 receptors). It is used to treat gastrointestinal ulcers. -- Pubchem; Ranitidine is a histamine H2-receptor antagonist that inhibits stomach acid production, and commonly used in the treatment of peptic ulcer disease (PUD) and gastroesophageal reflux disease (GERD). It is currently marketed by GlaxoSmithKline under the trade name Zantac. -- Wikipedia [HMDB] A - Alimentary tract and metabolism > A02 - Drugs for acid related disorders > A02B - Drugs for peptic ulcer and gastro-oesophageal reflux disease (gord) > A02BA - H₂-receptor antagonists C78276 - Agent Affecting Digestive System or Metabolism > C29701 - Anti-ulcer Agent > C29702 - Histamine-2 Receptor Antagonist D018377 - Neurotransmitter Agents > D018494 - Histamine Agents > D006633 - Histamine Antagonists D005765 - Gastrointestinal Agents > D000897 - Anti-Ulcer Agents

7-[(6-Hydroxy-3,7-dimethyl-2,7-octadienyl)oxy]-2H-1-benzopyran-2-one

7-{[(2E)-6-hydroxy-3,7-dimethylocta-2,7-dien-1-yl]oxy}-2H-chromen-2-one

7-[(6-Hydroxy-3,7-dimethyl-2,7-octadienyl)oxy]-2H-1-benzopyran-2-one is found in citrus. 7-[(6-Hydroxy-3,7-dimethyl-2,7-octadienyl)oxy]-2H-1-benzopyran-2-one is isolated from Citrus hassaku juice oil. Isolated from Citrus hassaku juice oil. 7-[(6-Hydroxy-3,7-dimethyl-2,7-octadienyl)oxy]-2H-1-benzopyran-2-one is found in citrus.

Gibberellin A120

(1R,2R,5R,8R,9S,10R,11R)-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.1^{5,8}.0^{1,10}.0^{2,8}]heptadec-13-ene-9-carboxylic acid

Gibberellin A120 (GA120) belongs to the class of organic compounds known as C19-gibberellin 6-carboxylic acids. These are C19-gibberellins with a carboxyl group at the 6-position. Gibberellin A120 is found in fruits. Gibberellin A120 is a constituent of immature Prunus persica (peach) seeds. Constituent of immature Prunus persica (peach) seeds. Gibberellin A120 is found in fruits and peach.

Litcubinine

2,9,10-trihydroxy-3-methoxy-7-methyl-5H,6H,7H,12H,12aH-indolo[2,1-a]isoquinolin-7-ium

C18H20NO4+ (314.1392)

Litcubinine is found in fruits. Litcubinine is an alkaloid from the roots of Litsea cubeba (mountain pepper

Menadiol dibutyrate

4-(Butanoyloxy)-3-methylnaphthalen-1-yl butanoic acid

Prothrombogenic vitamin. Prothrombogenic vitamin

N-[2-[[5-[(Dimethylamino)methyl]furan-2-yl]methylsulfanyl]ethyl]-N'-methyl-2-nitroethanimidamide

(1E)-N-{2-[({5-[(Dimethylamino)methyl]furan-2-yl}methyl)sulfanyl]ethyl}-N-methylnitroethanimidamide

3-[4-(3-Trifluoromethyl-phenyl)-piperazin-1-yl]-dihydrofuran-2-one

C15H17F3N2O2 (314.1242)

Dehydrocrotonin

5-(furan-3-yl)-2,5-dimethyl-3,4,4a,7,8,8a-hexahydro-2H-spiro[naphthalene-1,3-oxolane]-2,7-dione

Methyl 6,7-dimethoxy-4-ethyl-beta-carboline-3-carboxylate

Methyl 4-ethyl-6,7-dimethoxy-9H-pyrido[3,4-b]indole-3-carboxylic acid

Molinate

2-[6-(morpholin-4-yl)pyrimidin-4-yl]-4-(1H-1,2,3-triazol-1-yl)-2,3-dihydro-1H-pyrazol-3-one

C13H14N8O2 (314.124)

N-Desmethyllevomepromazine

[3-(2-methoxy-10H-phenothiazin-10-yl)-2-methylpropyl](methyl)amine

O-Desmethyllevomepromazine

10-[3-(dimethylamino)-2-methylpropyl]-10H-phenothiazin-2-ol

Ranisen

1-N-[2-[[5-[(dimethylamino)methyl]furan-2-yl]methylsulphanyl]ethyl]-1-N-methyl-2-nitroethene-1,1-diamine

Cyclopropyl-methoxycarbonyl metomidate

1-(Methoxycarbonyl)cyclopropyl 1-(1-phenylethyl)-1H-imidazole-5-carboxylic acid

D018377 - Neurotransmitter Agents > D018682 - GABA Agents > D018755 - GABA Agonists

Ratic

Ranitidine

7-(5-hydroxy-3,7-dimethylocta-2,6-dienyloxy)-chromen-2-one

Viridoside

(-)-Rel-(pR,9S,9S)-maximowicziol A

Eriosemation

Alnusdiol

Juniperoside II

TM 64

Cryptofolione

Drypetenone B

cis-Dehydrocrotonin

(E)-6-Hydroxy-7-(3-methyl-2-butenyl)-2-(3-oxobut-1-enyl)chroman-5-carbaldehyde

Karnatakafuran A

Anisocoumarin E

O-Methyloctandrenolone

Gelsedilam

Ferulagol A

7-[(3-Methyl-2-butenyl)oxy]-8-(3,3-dimethyloxiranylmethyl)-2H-1-benzopyran-2-one

Cribrostatin 5

8-Geranyl-5,7-dihydroxycoumarin

Ferulagol B

Gibberellin A73

Gibberellin A103

Perrottetin B

6beta-(2-Methylacryloyloxy)-9-oxoeuryopsin

(+)-7-(3-Methylbut-2-enyloxy)-8-(2-hydroxy-3-methylbut-3-enyl)coumarin

(+)-7-(3-Methylbut-2-enyloxy)-8-(4-hydroxy-3-methylbut-2-enyl)coumarin

Auraptenol

1alpha-Hydroxypseudoanisatin

2-(2,3-Dihydroxy-3-methylbutyl)-5-(2-phenylethenyl)-1,3-benzenediol

2,3-DehydroGA9

2,3-Didehydro-gibberellin A9

trans-Dehydrocrotonin

(+)-trans-Dehydrocrotonin

Grandiflorone

2,2,4,4-Tetramethyl-6- (1-oxo-3-phenylpropyl) -1,3,5-cyclohexanetrione

N-Bicyclo[2.2.1]hept-5-en-2-yl-N-(3-cyano-4,6-dimethyl-2-oxo-1,2-dihydropyridin-1-yl)thiourea

1,1-(2,6-dimethyl-4-(3-nitrophenyl)-1,4-dihydropyridine-3,5-diyl)diethanone

MCULE-6769322828

ZINC159409

6-(4-sulfophenyl)nonanoic acid

7-[(2E,5E)-7-hydroxy-3,7-dimethylocta-2,5-dienoxy]chromen-2-one

ZINC31167735

8-(4-sulfophenyl)nonanoic acid

8alpha-hydroxy-10-deoxycyclomerrillianolide

arachidin 4

8-geranyl-7-hydroxycoumarin|8-geranyloxy-7-hydroxycoumarin

erythro-1-(4-hydroxyphenyl)-2-(2-methoxy-4-(E)-propenylphenoxy)-propan-1-ol|erythro-1-(4-hydroxyphenyl)-2-<2-methoxy-4-(E)-propenylphenoxy>-propan-1-ol

Eriost? Acid|Eriostoic Acid

CHEMBL465166

DTXSID60555541

3-(1,1-Dimethylallyl)columbianetin

8-O-dihydrocaleteurcin angelate

Odoratin

neodunnianin

C19H22O4

1alpha,2alpha,3alpha,4alpha,10alpha-Pentahydroxyguaia-11(13)ene-12,6alpha-olide

beta-D-1C-(1S,2R,3R,4S,1,2,3,4,5-pentahydroxypentyl)glucopyranoside|diospyrodin

beta-D-1C-(1S*,2R*,3R*,4S*,1,2,3,4,5-pentahydroxypentyl)glucopyranoside|diospyrodin

Arucatriol

16-Nor-7,15-dioxodehydroabietic acid

1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)hept-6-en-3-ol

5-geranyloxy-7-hydroxycoumarin|5-geranyloxy-7-methoxycoumarin

(+)-(6R,2E)-epoxy-6,7 dimethyl-3,7 octene-2 oxy-7 coumarine|(+)-epoxy-6,7-auraptene|(+/-)-epoxy-6,7 dimethyl-3,7 octene-2 oxy-7 cumarine|(+/-)-epoxyaurapten|(E)-7-<<5-(3,3-dimethyloxiranyl)-3-methyl-2-pentenyl>oxy>-2H-1-benzopyran-2-one|(R)-(+)-aurapten-6,7-epoxyde|(R)-7-[5-(3,3-dimethyloxiranyl)-3-methylpent-2E-enyloxy]chromen-2-one|6,7-Epoxyauraptene|7-(6,7-epoxygeranyloxy)coumarin|7-[5-(3,3-dimethyloxiranyl)-3-methylpent-2E-enyloxy]chromen-2-one|7-{[(E)-5-(3,3-dimethyl-2-oxiranyl)-3-methyl-2-pentenyl]oxy}-2H-chromen-2-one|Epoxyaurapten|epoxyauraptene|geranyl umbelliferone monoepoxide

(+)-(6R,2E)-epoxy-6,7 dimethyl-3,7 octene-2 oxy-7 coumarine|(+)-epoxy-6,7-auraptene|(+/-)-epoxy-6,7 dimethyl-3,7 octene-2 oxy-7 cumarine|(+/-)-epoxyaurapten|(E)-7-<<5-(3,3-dimethyloxiranyl)-3-methyl-2-pentenyl>oxy>-2H-1-benzopyran-2-one|(R)-(+)-aurapten-6,7-epoxyde|(R)-7-[5-(3,3-dimethyloxiranyl)-3-methylpent-2E-enyloxy]chromen-2-one|6,7-Epoxyauraptene|7-(6,7-epoxygeranyloxy)coumarin|7-[5-(3,3-dimethyloxiranyl)-3-methylpent-2E-enyloxy]chromen-2-one|7-{[(E)-5-(3,3-dimethyl-2-oxiranyl)-3-methyl-2-pentenyl]oxy}-2H-chromen-2-one|Epoxyaurapten|epoxyauraptene|geranyl umbelliferone monoepoxide

Platyphyllonol

6-(6-hydroxy-3,7-dimethylocta-2,7-dienyl)-7-hydroxycoumarin

Antrodin A

Di-Ac-(Z)-1,9,14-Pentadecatriene-4,6-diyne-3,8-diol

Abietinarin A

Acerogenin F|Acerogenin J

1-(4-hydroxyphenyl)-2-propanol 4-O-beta-D-glucopyranoside

Trimeprazine sulfoxide

Sophorachromone A

Myrsellin

5-oxo-6,7-dihydroaureptene|7-(3,7-dimethyl-6-oxo-(2E)-2-octenyloxy)coumarin|7-<3,7-dimethyl-6-oxo-(2E)-2-octenyloxy>coumarin

Di-Me ether-Sequirin A

3-(3,3-dimethylallyl)-marmesin|dl-3-(3,3-dimethylallyl)marmesin

(+-)-Brombyin 6|brombyin-VI

(+-)-Latifolin-dimethylether|(+-)-Latifolindimethylether|2,5-Dihydro-2-methoxy-2,5-di-O-methyl-dalbergion|Latifolin-dimethylether|Latifolindimethylether

10??-Hydroxypseudoanisatin

NSC309450

10??-Hydroxycyclopseudoanisatin

(2S,3R,3aR,4R,4S,5R,7R,8aR)-octahydro-3,4-dihydroxy-3-(hydroxymethyl)-5-methyl-3H-spiro[4,7-methanofuro[3,2-c]oxepine-2,2-pyran]-6(4H)-one|glochicoccin A

2-O-beta-D-galactofuranosyl-D-arabinitol|O2-beta-D-Galactofuranosyl-D-arabit|O2-beta-D-galactofuranosyl-D-arabitol

Di-Me ether-(R)-Latifolin

2,3-trans-3,4-cis-4,5-cis-5-(4-Hydroxyphenyl)-2-(4-hydroxy-3-methoxyphenyl)-3,4-dimethyltetrahydrofuran

Franklinone

(4E,6Z,12E)-3-O-(3-Methyl-2-butenoyl)-4,6,12-Tetradecatriene-8,10-diyne-1,3,14-triol,

(2R,3R)-2,3-dihydro-2-(4-hydroxy-3-methoxyphenyl)-5-(3-hydroxypropyl)-3-methylbenzofuran|3-Methoxy-2,3-Dihydro-2-(4-hydroxyphenyl)-5-(e-hydroxypropyl)-3-methylbenzofuran

Gramilaurone

7-geranyloxy-5-hydroxycoumarin

13,15-Diacetoxy-pentadecatrien-(2t,8t,10t)-diin-(4,6)|Centaur X(2)|Centaur X2

8alpha-methacryloyloxy dehydrocostus lactone

Decarboxyisocolumbin|tinocallone B

Neocryptotanshinone

Neocryptotanshinone, a fatty diterpenoids from Salvia Miltiorrhiza, inhibits lipopolysaccharide-induced inflammation by suppression of NF-κB and iNOS signaling pathways[1][2]. Neocryptotanshinone, a fatty diterpenoids from Salvia Miltiorrhiza, inhibits lipopolysaccharide-induced inflammation by suppression of NF-κB and iNOS signaling pathways[1][2].

1alpha-hydroxypseudoanisatin|1??-Hydroxypseudoanisatin

kallisteine B

Amoenin

MCULE-3992778556

7-(3,7-Dimethyl-5-oxo-6-octenyloxy)coumarin

3,7-dihydroxy-6,8-bis(3-methylbut-2-en-1-yl)-4H-1-benzopyran-4-one|3,7-dihydroxy-6,8-bis(3-methylbut-2-en-1-yl)-4H-chromen-4-one|eryvarin X

4-(4-hydroxy-3-methoxyphenyl)-1-(4-hydroxyphenyl)-2,3-dimethylbutan-1-one

(8R,8S)-7-(3,4-methylenedioxyphenyl)-8,8-dimethyl-7-(3,4-dihydroxyphenyl)-butane

1,5-epoxy-1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)heptane

pallambin D

(3S)-2-(4-hydroxyphenyl)ethyl 3-hydroxy-5-phenylpentanoate|(3S)-3-hydroxy-5-phenylpentanoic acid 2-(4-hydroxyphenyl)ethyl ester

Dimethyl (methylenebis(4,1-phenylene))dicarbamate

1-(4-hydroxyphenyl)-7-(3,4-dihydroxyphenyl)heptan-3-one|muricarpin

1-(4-methoxy-2,5-dimethylphenyl)-beta-D-glucopyranose|dunnianoside H

C15H22O7

2beta-Hydroxyjatropholone

(1R,3R,5R)-1,7-bis(4-hydroxyphenyl)-1,5-epoxy-3-hydroxyheptane

grevilloside G

Diorcinol E

5,7-dimethoxy-4-hydroxy-6,8-dimethylflavan

15-hydroxy-1-oxosalvibretol

2-alpha-D-glucosylribitol

Doitungbiphenyl B

1,13,14-trihydroxy-3,4-anhydrofloridanolide|dunnianolide B

ACMC-20moqc

(??)-3鈥樎?6鈥樎?Epoxycycloauraptene|3鈥樎?6鈥樎?Epoxycycloauraptene

(11)7,14-ortholactone of 14-hydroxy-3-oxofloridanolide

BEN293

merrillianolide

11,13-dihydro-15-carboxyelemane

2alpha-hydroxycycloparviflorolide

(E)-6-(7-hydroxy-3,7-dimethylocta-2,5-dienyl)-7-hydroxycoumarin|7-Hydroxy-6-(7-hydroxy-3,7-dimethyl-2,5-octadienyl)-2H-1-benzopyran-2-one

carexane O

cyclomerrillianolide

5,7-Dihydroxy-8-lavandulyl-4H-1-benzopyran-4-one|exiguachromone A

4鈥樎?4鈥樎?Di-Me ether 鈥樎???)-Agatharesinol

7-O-(3-Methyl-2-butenyl)-7-Hydroxy-8-(2-hydroxy-3-methyl-3-butenyl)-2H-1-benzopyran-2-one

(4E)-1,5-bis(4-hydroxyphenyl)-2-(methoxymethyl)-4-penten-1-ol

Acerogenin I

ACMC-20m5eh

trigonostemon D

Yaterisinoldimethylether

ACMC-20moqd

CHEMBL4062499

brombycin I

6-hydroxy-beta-cycloaurapten

1-O-beta-D-Galactopyranosyl-D-ribitol

Penicillin DF

NCI60_031207

1,4-Phenanthrenedione, 5,6,7,8-tetrahydro-3-hydroxy-2-[(1R)-2-hydroxy-1-methylethyl]-8,8-dimethyl-

1-hydroxy-2-[(2R)-1-hydroxypropan-2-yl]-8,8-dimethyl-6,7-dihydro-5H-phenanthrene-3,4-dione is a natural product found in Salvia miltiorrhiza with data available. Neocryptotanshinone, a fatty diterpenoids from Salvia Miltiorrhiza, inhibits lipopolysaccharide-induced inflammation by suppression of NF-κB and iNOS signaling pathways[1][2]. Neocryptotanshinone, a fatty diterpenoids from Salvia Miltiorrhiza, inhibits lipopolysaccharide-induced inflammation by suppression of NF-κB and iNOS signaling pathways[1][2].

Anisocoumarin H

7-[(2E)-5-hydroxy-3,7-dimethylocta-2,6-dienoxy]chromen-2-one

Anisocoumarin H is a natural product found in Esenbeckia grandiflora and Zanthoxylum rhoifolium with data available.

2-(2-hydroxypropan-2-yl)-9-(3-methylbut-2-enyl)-2,3-dihydrofuro[3,2-g]chromen-7-one

NCGC00347815-02!2-(2-hydroxypropan-2-yl)-9-(3-methylbut-2-enyl)-2,3-dihydrofuro[3,2-g]chromen-7-one

5-hydroxy-1,7-bis(4-hydroxyphenyl)heptan-3-one

NCGC00384784-01!5-hydroxy-1,7-bis(4-hydroxyphenyl)heptan-3-one

4-(7-hydroxy-6-methoxy-2,3-dimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)benzene-1,2-diol

NCGC00384717-01!4-(7-hydroxy-6-methoxy-2,3-dimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)benzene-1,2-diol

1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one

NCGC00381065-01!1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one

(2S)-2-(2-hydroxypropan-2-yl)-6-(2-methylbut-3-en-2-yl)-2,3-dihydrofuro[3,2-g]chromen-7-one

NCGC00169223-03!(2S)-2-(2-hydroxypropan-2-yl)-6-(2-methylbut-3-en-2-yl)-2,3-dihydrofuro[3,2-g]chromen-7-one

7-[(2E)-5-hydroxy-3,7-dimethylocta-2,6-dienoxy]chromen-2-one

NCGC00168829-02!7-[(2E)-5-hydroxy-3,7-dimethylocta-2,6-dienoxy]chromen-2-one

SPA-9C (TENTATIVE)

TENTATIVELY IDENTIFIED SPECTRUM ONLY!!!!!!!!!; Extracted (without noise removal) from ZUE_N: mz313_11_rt10_56_HCD60_SPA-9C; CONFIDENCE Tentative identification: isomers possible (Level 3); Good match to 6phiC9SPC, LIT00035

C19H22O4_(2R,3R,4aS,5R,8aS)-5-(3-Furyl)-2,5-dimethyl-4,4a,8,8a-tetrahydro-2H-spiro[furan-3,1-naphthalene]-4,7(3H,5H)-dione

NCGC00384799-01_C19H22O4_(2R,3R,4aS,5R,8aS)-5-(3-Furyl)-2,5-dimethyl-4,4a,8,8a-tetrahydro-2H-spiro[furan-3,1-naphthalene]-4,7(3H,5H)-dione

6-(1,1-Dimethylallyl)-2-(1-hydroxy-1-methylethyl)-2,3-dihydro-7H-furo[3,2-G]chromen-7-one

2-(2-hydroxypropan-2-yl)-9-(3-methylbut-2-enyl)-2,3-dihydrofuro[3,2-g]chromen-7-one

1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one

8phiC9SPC

Literature spectrum; CONFIDENCE Identification confirmed with Reference Standard (Level 1); Digitised from figure: approximate intensities

6phiC9SPC

Literature spectrum; CONFIDENCE Identification confirmed with Reference Standard (Level 1); Digitised from figure: approximate intensities

TiaprideMet

Alimemazine (oxide)

Sulfoxide

Alimemazine (oxide)

5-hydroxy-1,7-bis(4-hydroxyphenyl)heptan-3-one [IIN-based on: CCMSLIB00000846659]

NCGC00384784-01!5-hydroxy-1,7-bis(4-hydroxyphenyl)heptan-3-one [IIN-based on: CCMSLIB00000846659]

5-hydroxy-1,7-bis(4-hydroxyphenyl)heptan-3-one [IIN-based: Match]

NCGC00384784-01!5-hydroxy-1,7-bis(4-hydroxyphenyl)heptan-3-one [IIN-based: Match]

7-[(2E)-5-hydroxy-3,7-dimethylocta-2,6-dienoxy]chromen-2-one [IIN-based: Match]

NCGC00168829-02!7-[(2E)-5-hydroxy-3,7-dimethylocta-2,6-dienoxy]chromen-2-one [IIN-based: Match]

7-[(2E)-5-hydroxy-3,7-dimethylocta-2,6-dienoxy]chromen-2-one [IIN-based on: CCMSLIB00000848851]

NCGC00168829-02!7-[(2E)-5-hydroxy-3,7-dimethylocta-2,6-dienoxy]chromen-2-one [IIN-based on: CCMSLIB00000848851]

trimethylene bis(4-aminobenzoate)

Propane-1,3-diyl bis(4-aminobenzoate)

CONFIDENCE standard compound; INTERNAL_ID 291; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7854; ORIGINAL_PRECURSOR_SCAN_NO 7850 CONFIDENCE standard compound; INTERNAL_ID 291; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7867; ORIGINAL_PRECURSOR_SCAN_NO 7864 CONFIDENCE standard compound; INTERNAL_ID 291; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7905; ORIGINAL_PRECURSOR_SCAN_NO 7903 CONFIDENCE standard compound; INTERNAL_ID 291; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7898; ORIGINAL_PRECURSOR_SCAN_NO 7895 CONFIDENCE standard compound; INTERNAL_ID 291; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7906; ORIGINAL_PRECURSOR_SCAN_NO 7902

2-(2-hydroxypropan-2-yl)-9-(3-methylbut-2-enyl)-2,3-dihydrofuro[3,2-g]chromen-7-one_major

1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)heptan-3-one_major

7-[(2E,5E)-7-hydroxy-3,7-dimethylocta-2,5-dienoxy]chromen-2-one_major

ANISOCOUMARIN H_major

6-(1,1-DIMETHYLALLYL)-2-(1-HYDROXY-1-METHYLETHYL)-2,3-DIHYDRO-7H-FURO[3,2-G]CHROMEN-7-ONE_major

Desmethylmethotrimeprazine

O-Desmethyllevomepromazine

Litcubinine

2,9,10-trihydroxy-3-methoxy-7-methyl-5H,6H,7H,12H,12aH-indolo[2,1-a]isoquinolin-7-ium

C18H20NO4 (314.1392)

Karan

4-(butanoyloxy)-2-methylnaphthalen-1-yl butanoate

gibberellin A120

11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.1^{5,8}.0^{1,10}.0^{2,8}]heptadec-13-ene-9-carboxylic acid

7-(6R-Hydroxy-3,7-dimethylocta-2,5-dienyl)-7-hydroxycoumarin

7-{[(2E)-6-hydroxy-3,7-dimethylocta-2,7-dien-1-yl]oxy}-2H-chromen-2-one

1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-3-heptanone

1,2,4-triphenylbutane-1,4-dione

2,4,5-TRIETHOXYBENZOPHENONE

Disperse Red 1

Pimefylline

C15H18N6O2 (314.1491)

C78274 - Agent Affecting Cardiovascular System > C29707 - Vasodilating Agent C471 - Enzyme Inhibitor > C744 - Phosphodiesterase Inhibitor

(R,R)-(+)-1,2-DI(1-NAPHTHYL)-1,2-ETHANEDIOL

2-[4-(2-Pyridinyl)phenyl]-1H-benzimidazole-4-carboxamide

C19H14N4O (314.1168)

4-(2-Boc-amino-pyridin-4-yl)-benzoic acid

N-Fmoc-L-Alanine-3,3,3-D3

C18H14D3NO4 (314.1346)

N1,N3-BIS(2-METHOXYPHENYL)MALONAMIDE

tert-Butoxycarbonyl-L-valine N-hydroxysuccinimide ester

C14H22N2O6 (314.1478)

2-[[2-[1-methyl-5-(4-methylbenzoyl)pyrrol-2-yl]acetyl]amino]acetic acid

4-[(4-METHYL-BENZYLAMINO)-METHYL]-3-NITRO-BENZOICACIDMETHYLESTER

(S S)-(-)-1-(1-NAPHTHYL)-2-(2-NAPHTHYL)&

methopromazine

C78272 - Agent Affecting Nervous System > C29710 - Antipsychotic Agent

(3-((2-Morpholinoethyl)carbamoyl)phenyl)boronic acid hydrochloride

C13H20BClN2O4 (314.1205)

1-(4-methoxyphenyl)-2,3,4,9-tetrahydro-1H-beta-carboline hydrochloride

2-((tert-Butyldiphenylsilyl)oxy)acetic acid

C18H22O3Si (314.1338)

(S,S)-(-)-1,2-DI(1-NAPHTHYL)-1,2-ETHANEDIOL

6,6?ˉ-DIMETHYL-1,1?ˉ-BI-2-NAPHTHOL

Benzoic acid, 4-(hexyloxy)-, 4-hydroxyphenyl ester

4-(1-Phenyl-1H-benzimidazol-2-yl)phenylboronic acid

C19H15BN2O2 (314.1227)

2-(4-((TERT-BUTOXYCARBONYL)AMINO)PHENYL)NICOTINIC ACID

phenmedipham-ethyl

Methyl 6,7-dimethoxy-4-ethyl-beta-carboline-3-carboxylate

DMCM hydrochloride,4-Ethyl-6,7-dimethoxy-9H-pyrido[3,4-b]indole-3-carboxylicacidmethylesterhydrochloride

D002491 - Central Nervous System Agents > D000697 - Central Nervous System Stimulants > D003292 - Convulsants

[4-(2-Phenyl-1H-benzimidazol-1-yl)phenyl]-boronic acid

C19H15BN2O2 (314.1227)

(3-(4-(2-Hydroxyethyl)piperazine-1-carbonyl)phenyl)boronic acid hydrochloride

C13H20BClN2O4 (314.1205)

1-Propanol,2-[(tetrahydro-2H-pyran-2-yl)oxy]-,4-methylbenzenesulfonate,(2S)-

Benzoic acid, 4-butoxy-, 4-ethoxyphenyl ester

2-[4-(4-chlorophenyl)phenyl]-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

C18H20BClO2 (314.1245)

Pentadecylmagnesium bromide solution

C15H31BrMg (314.1459)

Lorcinadol

C17H19ClN4 (314.1298)

C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent

diethyl 2-(3-phenylprop-2-ynyl)-2-prop-2-enylpropanedioate

6,7-dimethoxy-1-(4-nitrophenyl)-1,2,3,4-tetrahydroisoquinoline

3-(1-phenyl-1H-benzo[d]iMidazol-2-yl)phenylboronic acid

C19H15BN2O2 (314.1227)

2-[4-[(4-nitrophenyl)diazenyl]-N-(2,2,2-trideuterioethyl)anilino]ethanol

5-Hydroxyplatyphyllone M

5-Hydroxy-1,7-bis(4-hydroxyphenyl)heptan-3-one

methyl (E)-2-[(2-hydroxy-4,4-dimethyl-6-oxocyclohexen-1-yl)methyl]-3-phenylprop-2-enoate

Molidustat

C13H14N8O2 (314.124)

C471 - Enzyme Inhibitor Molidustat (BAY 85-3934) is a novel inhibitor of hypoxia-inducible factor prolyl hydroxylase (HIF-PH) with mean IC50 values of 480 nM for PHD1, 280 nM for PHD2, and 450 nM for PHD3.

2-(4-Benzylpiperazino)-5-fluorobenzoic Acid

(E)-3-[2-Cyclopropyl-4-(4-fluorophenyl)-3-quinolinyl]-2-propenenitrile

C21H15FN2 (314.1219)

Bis-PEG5-thiol

C12H26O5S2 (314.1222)

2,2-Dimethoxy-1,1-binaphthalen

phenyl-(2,3,4-triethoxyphenyl)methanone

4-benzhydrylpiperazine-1-carbonyl chloride

(R,R)-(+)-1-(1-Naphthyl)-2-(2-naphthyl)-1,2-ethanediol

[3-(9,9-Dimethyl-9H-fluoren-2-yl)phenyl]boronic acid

C21H19BO2 (314.1478)

7,8-Bis[(3-methyl-2-buten-1-yl)oxy]-2H-1-benzopyran-2-one

Cobimetinib intermediate7

C15H17F3N2O2 (314.1242)

2-(1,3-b

4-Chloro-2-fluoro-5-propoxyphenylboronic acid, pinacol ester

C15H21BClFO3 (314.1256)

2-(4-Chloro-2-fluoro-5-isopropoxyphenyl)-4,4,5,5-tetramethyl-1,3,2-dioxaborolane

C15H21BClFO3 (314.1256)

3-(4-((TERT-BUTOXYCARBONYL)AMINO)PHENYL)PICOLINIC ACID

1,1-Binaphthalene, 2,2-dimethoxy-, (±)-

MAZ51

3-(4-Dimethylamino-naphthalen-1-ylmethylene)-1,3-dihydro-indol-2-one

C21H18N2O (314.1419)

4-[4-(2-Hydroxyethyl)-1-piperazinylcarbonyl]benzeneboronic acid

C13H20BClN2O4 (314.1205)

METHYL 6-(4-METHOXYPHENYLAMINO)-5-OXO-1,2,3,5-TETRAHYDROINDOLIZINE-8-CARBOXYLIATE

1,2-Hydrazinedicarboxylicacid, 1-methyl-, 1,2-bis(phenylmethyl) ester

4-(4-Benzyl-1-piperazinyl)-3-fluorobenzoic acid

Raxatrigine

C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent

1H-Imidazole-5-carboxylic acid, 1-((1R)-1-phenylethyl)-, 1-(methoxycarbonyl)cyclopropyl ester

D018377 - Neurotransmitter Agents > D018682 - GABA Agents > D018755 - GABA Agonists

3-Hydroxytrimeprazine

4-Cyclohexene-1,3-dione, 5-hydroxy-2,2,6,6-tetramethyl-4-(1-oxo-3-phenylpropyl)-

Dimethyl 5,5-methylenedianthranilate

Tolycaine hydrochloride

C15H23ClN2O3 (314.1397)

1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)-(6E)-6-hepten-3-ol

A diarylheptanoid that is (6E)-6-hepten-3-ol substituted by a 3,4-dihydroxyphenyl group at position 1 and a 4-hydroxyphenyl group at position 7 respectively. It has been isolated from the rhizomes of Curcuma comosa.

N-[1-oxo-2-(4-propan-2-ylphenoxy)ethyl]-2-pyrazinecarbohydrazide

N-cyclopentyl-2-[[6-(2-pyridinyl)-3-pyridazinyl]thio]acetamide

Aminocyclopyrachlor-triethylammonium

C14H23ClN4O2 (314.1509)

7-[[(2E,5E)-7-Hydroxy-3,7-dimethyl-2,5-octadienyl]oxy]-2H-1-benzopyran-2-one

1,4-Dimethoxy-9-phenylanthracene

N-[2-(Diethylamino)ethyl]-2-hydroxy-5-(methylsulfonyl)benzamide (Desmethyltiapride)

2-Hydroxy-5-{[(1E)-2-phenylethylidene]amino}-L-tyrosine

8-Methyl-8-(4-sulfophenyl)octanoic acid

4-(7-Hydroxy-6-methoxy-2,3-dimethyl-1,2,3,4-tetrahydronaphthalen-1-yl)benzene-1,2-diol

11-Methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadec-13-ene-9-carboxylic acid

N-Desmethyllevomepromazine

[3-(2-methoxy-10H-phenothiazin-10-yl)-2-methylpropyl](methyl)amine

(1R,2R,5R,8R,9S,10R,11S)-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.15,8.01,10.02,8]heptadec-13-ene-9-carboxylic acid

(-)-(3S)-1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)-(6E)-6-hepten-3-ol

A diarylheptanoid that is (6E)-6-hepten-3-ol substituted by a 3,4-dihydroxyphenyl group at position 1 and a 4-hydroxyphenyl group at position 7 (the 3S-stereoisomer). It has been isolated from the rhizomes of Curcuma kwangsiensis.

2,3-Didehydro-gibberellin A9

(+)-(7S,8S,8S)-3,4,4-trihydroxy-5-methoxy-2,7-cyclolignan

A lignan that is 1,2,3,4-tetrahydronaphthalene substituted by methyl groups at positions 2 and 3, a hydroxy group at position 7, a methoxy group at position 6 and a 3,4-dihydroxyphenyl group at position 1. It has been isolated from the bark of Machilus robusta.

(+)-(3R)-1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)-(6E)-6-hepten-3-ol

A diarylheptanoid that is (6E)-6-hepten-3-ol substituted by a 3,4-dihydroxyphenyl group at position 1 and a 4-hydroxyphenyl group at position 7 (the 3R-stereoisomer). It has been isolated from the rhizomes of Curcuma kwangsiensis.

Huprine W

1-[[Oxo(3-pyridinyl)methyl]amino]-3-(4-propan-2-ylphenyl)thiourea

N-[(E)-[4-(4-Fluoroanilino)-4-oxobutan-2-ylidene]amino]pyridine-2-carboxamide

C16H15FN4O2 (314.1179)

(E)-N-(4-Methylpiperazin-1-yl)-1-[5-(4-nitrophenyl)furan-2-yl]methanimine

(2-Methyl-3-imidazo[1,2-a]pyridinyl)-diphenylmethanol

C21H18N2O (314.1419)

1-(2,5-Dimethoxyphenyl)sulfonyl-4-ethylpiperazine

N-[2-[(phenylmethyl)amino]-1,3-benzodioxol-2-yl]carbamic acid ethyl ester

3-(2-fluorophenyl)-2-(4-fluorophenyl)-5,6,7,7a-tetrahydro-3H-pyrrolo[1,2-c]imidazol-1-one

C18H16F2N2O (314.1231)

1-[[2-(3-Methylanilino)-1-oxoethyl]amino]-3-phenylthiourea

N-[2-(1-naphthalenyloxy)-1-oxoethyl]-2-oxolanecarbohydrazide

(7-Methoxy-4,5-dihydrobenzo[g][1,2]benzoxazol-3-yl)-(4-morpholinyl)methanone

1,4-dideoxy-1-({2,6-dioxo-5-[(E)-(2-oxopropylidene)amino]-1,2,3,6-tetrahydropyrimidin-4-yl}amino)-D-erythro-pentitol

C12H18N4O6 (314.1226)

6-(butan-2-ylthio)-1-(4-methylphenyl)-2H-pyrazolo[3,4-d]pyrimidin-4-one

N-(3-O-phospho-D-ribulosyl)-cadaverine

C10H23N2O7P (314.1243)

3-{(3E)-4-hydroxy-6-oxo-3-[(2-phenylethyl)imino]cyclohexa-1,4-dien-1-yl}-L-alanine

A non-proteinogenic L-alpha-amino acid obtained by formal condensation of the 3-oxo group of L-topaquinone with the amino group of 2-phenylethylamine.

1,2-dideoxy-1-({2,6-dioxo-5-[(E)-(2-oxopropylidene)amino]-1,2,3,6-tetrahydropyrimidin-4-yl}amino)-D-erythro-pentitol

C12H18N4O6 (314.1226)

2-[[(2R)-2-acetyloxy-3-methoxypropoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium

2-fluoro-N-[[(2S,3R,4S)-4-(hydroxymethyl)-3-phenyl-2-azetidinyl]methyl]benzamide

2-fluoro-N-[[(2S,3S,4S)-4-(hydroxymethyl)-3-phenyl-2-azetidinyl]methyl]benzamide

[(1S,2aS,8bS)-2-[(2-chlorophenyl)methyl]-2a,3,4,8b-tetrahydro-1H-azeto[2,3-c]quinolin-1-yl]methanol

[(1R,2aR,8bR)-2-[(2-chlorophenyl)methyl]-2a,3,4,8b-tetrahydro-1H-azeto[2,3-c]quinolin-1-yl]methanol

2-fluoro-N-[[(2R,3S,4R)-4-(hydroxymethyl)-3-phenyl-2-azetidinyl]methyl]benzamide

2-fluoro-N-[[(2R,3R,4R)-4-(hydroxymethyl)-3-phenyl-2-azetidinyl]methyl]benzamide

[(1S,2aR,8bR)-2-[(2-chlorophenyl)methyl]-2a,3,4,8b-tetrahydro-1H-azeto[2,3-c]quinolin-1-yl]methanol

[(1R,2aS,8bS)-2-[(2-chlorophenyl)methyl]-2a,3,4,8b-tetrahydro-1H-azeto[2,3-c]quinolin-1-yl]methanol

5-D-5-OP-RU

C12H18N4O6 (314.1226)

(2S)-3-(2-methoxyphenothiazin-10-yl)-N,2-dimethylpropan-1-amine

2-(3,4-dichlorophenyl)-N-methyl-N-[(1-methylpiperidin-2-yl)methyl]ethanamine

C16H24Cl2N2 (314.1316)

an (S)-cis-N-methyl-7,8,13,14-tetrahydroprotoberberine

C18H20NO4+ (314.1392)

2-[hydroxy-[(2R)-2-hydroxy-3-propanoyloxypropoxy]phosphoryl]oxyethyl-trimethylazanium

[(3R,4R)-1-(5-aminopentylamino)-4,5-dihydroxy-2-oxopentan-3-yl] dihydrogen phosphate

C10H23N2O7P (314.1243)

2-[hydroxy-[(2R)-3-hydroxy-2-propanoyloxypropoxy]phosphoryl]oxyethyl-trimethylazanium

2-[Hydroxy-(2-hydroxy-3-propanoyloxypropoxy)phosphoryl]oxyethyl-trimethylazanium

Chalepin

D011838 - Radiation-Sensitizing Agents > D017319 - Photosensitizing Agents > D011564 - Furocoumarins

2-hydroxy-5-[(1E)-(2-phenylethylidene)amino]-L-tyrosine

An imine that is L-tyrosine bearing an additional hydroxy substituent at position 2 as well as a (2-phenylethylidene)amino substituent at position 5.

Menadiol dibutyrate

7-[(6-Hydroxy-3,7-dimethyl-2,7-octadienyl)oxy]-2H-1-benzopyran-2-one

Litcubinine

C18H20NO4+ (314.1392)

2,3-Dehydro-gibberellin A9

2,3-Didehydro-gibberellin A9

A C19-gibberellin obtained by formal dehydrogenation across the 2,3-position of gibberellin A9.

Cyclo(Gln-Trp)

Didehydro-gibberellin A9

ST 19:5;O4

Antrodin A

Antrodin A is one of the main active ingredients in the solid-state fermented A. camphorate mycelium. Antrodin A protects the liver from alcohol damage by improving the antioxidant and anti-inflammatory capacity of the liver and maintaining the stability of the intestinal flora[1].

2-[(1r,2s,4s,5r,6r)-5-[(1s)-1-carboxy-1-hydroxyethyl]-2-ethenyl-4,6-dihydroxy-2-methylcyclohexyl]prop-2-enoic acid

(9r,11r)-tricyclo[12.3.1.1²,⁶]nonadeca-1(18),2(19),3,5,14,16-hexaene-3,9,11,17-tetrol

4-[3-hydroxy-7-(4-hydroxyphenyl)hept-6-en-1-yl]benzene-1,2-diol

9h-pyrido[3,4-b]indole-3-carboxylic acid; methyl isobutyrate

1-(4-methoxyphenyl)-2-[2-(4-methoxyphenyl)ethenyl]propane-1,3-diol

1-[2-(2h-1,3-benzodioxol-5-yl)-3-hydroxy-1,2,3,5,6,7,8,8a-octahydronaphthalen-1-yl]ethanone

1-(acetyloxy)pentadeca-5,7,13-trien-9,11-diyn-3-yl acetate

1-[(1r,4s,4as,8as)-2-(2h-1,3-benzodioxol-5-yl)-4-hydroxy-1,4,4a,5,6,7,8,8a-octahydronaphthalen-1-yl]ethanone

3a-chloro-2-(2-hydroxypropan-2-yl)-6-(3-methylbuta-1,3-dien-1-ylidene)-hexahydro-1-benzofuran-4,5-diol

C16H23ClO4 (314.1285)

7-{[(2e)-5-hydroxy-3,7-dimethylocta-2,6-dien-1-yl]oxy}chromen-2-one

(6r)-6-[(1e,4r,6r,7e)-4,6-dihydroxy-8-phenylocta-1,7-dien-1-yl]-5,6-dihydropyran-2-one

4-{[5-(1,2-dihydroxyethyl)-3,4-dihydroxyoxolan-2-yl]oxy}pentane-1,2,3,5-tetrol

1-[(1r,2s,3r,8ar)-2-(2h-1,3-benzodioxol-5-yl)-3-hydroxy-1,2,3,5,6,7,8,8a-octahydronaphthalen-1-yl]ethanone

4-[5-hydroxy-5-(4-hydroxyphenyl)-4-(methoxymethyl)pent-1-en-1-yl]phenol

4-[(3r,6e)-3-hydroxy-7-(4-hydroxyphenyl)hept-6-en-1-yl]benzene-1,2-diol

7-{[(2e)-5-[(2s)-3,3-dimethyloxiran-2-yl]-3-methylpent-2-en-1-yl]oxy}chromen-2-one

1-hydroxy-2-(1-hydroxypropan-2-yl)-8,8-dimethyl-6,7-dihydro-5h-phenanthrene-3,4-dione

(2s,3s,4r)-4-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}pentane-1,2,3,5-tetrol

(1s,2r,6s,7r,8s,10r,13r)-2,7,8-trihydroxy-6-(hydroxymethyl)-7,13-dimethyl-4,9-dioxatetracyclo[6.5.1.0¹,¹⁰.0⁶,¹⁰]tetradecan-3-one

(2s,3r,4s,5s,6r)-2-{2-[(1s)-1-hydroxyethyl]-3-methylphenoxy}-6-(hydroxymethyl)oxane-3,4,5-triol

(3as,6r,6ar,7r,8s,9r,9as,9bs)-6,6a,7,8,9-pentahydroxy-6,9-dimethyl-3-methylidene-hexahydro-3ah-azuleno[4,5-b]furan-2-one

4,12,13-trihydroxy-9-(hydroxymethyl)-6,10-dimethyl-3,14-dioxatetracyclo[6.5.1.0¹,¹⁰.0⁴,⁹]tetradecan-5-one

1-(4-hydroxyphenyl)-2-propanol

{"Ingredient_id": "HBIN001504","Ingredient_name": "1-(4-hydroxyphenyl)-2-propanol","Alias": "NA","Ingredient_formula": "C15H22O7","Ingredient_Smile": "NA","Ingredient_weight": "314.335","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "9667","PubChem_id": "NA","DrugBank_id": "NA"}

1α-hydroxypseudoanisatin

{"Ingredient_id": "HBIN002310","Ingredient_name": "1\u03b1-hydroxypseudoanisatin","Alias": "NA","Ingredient_formula": "C15H22O7","Ingredient_Smile": "CC1(CC(C2(C13CC(=O)C(C2(COC(=O)C3)C)(C)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10667","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

(1r,2r,8s,9s,10r)-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.1⁵,⁸.0¹,¹⁰.0²,⁸]heptadec-13-ene-9-carboxylic acid

(1r,2r,5r,8s,9s,10r,11r)-11-methyl-6-methylidene-16-oxo-15-oxapentacyclo[9.3.2.1⁵,⁸.0¹,¹⁰.0²,⁸]heptadec-13-ene-9-carboxylic acid

(1r,2s,4r,9r,11s,12r,13r)-2,11,12-trihydroxy-13-(hydroxymethyl)-12,13-dimethyl-6,14-dioxatetracyclo[9.2.1.0¹,⁹.0⁴,⁹]tetradecan-7-one

(1s,4s,6s,8s,9r,10s,12r,13s)-4,12,13-trihydroxy-9-(hydroxymethyl)-6,10-dimethyl-3,14-dioxatetracyclo[6.5.1.0¹,¹⁰.0⁴,⁹]tetradecan-5-one

(1's,2s,2'r,3's,4'r,7'r,9'r,10'r,11's)-2'-(hydroxymethyl)-1',5'-dimethyl-8'-oxaspiro[oxirane-2,12'-tricyclo[7.2.1.0²,⁷]dodecan]-5'-ene-3',4',10',11'-tetrol

(1r,2r,5r,6s,8r,10r,13r,14r)-2,10,13,14-tetrahydroxy-1,5,13-trimethyl-9,11-dioxatetracyclo[6.4.1.1⁶,¹⁰.0²,⁶]tetradecan-3-one