Exact Mass: 350.13922600000006
Exact Mass Matches: 350.13922600000006
Found 500 metabolites which its exact mass value is equals to given mass value 350.13922600000006,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Estrone 3-sulfate
Estrone sulfate is a sulfated estrone derivative. Estrone sulfate acts as a long-lived reservoir that can be converted as needed to the more active estradiol (from estrone via 17 beta-hydroxysteroid dehydrogenase). Estrone Sulfate (E1S) is the most abundant circulating estrogen in non-pregnant women as well as normal men. Estrone is primarily synthesized from estrone sulfate. Estrone is an estrogenic hormone secreted by the ovaries and adipose tissues. Estrone is one of the three estrogens found in humans. The other two are estriol and estradiol. Estrone is the least prevalent of the three. Estradiol plays a critical role on reproductive and sexual functioning in women and it also affects other organs including the bones. Estriol is an estrogen that is prevalent primarily during pregnancy. [HMDB] Estrone sulfate is a sulfated estrone derivative. Estrone sulfate acts as a long-lived reservoir that can be converted as needed to the more active estradiol (from estrone via 17 beta-hydroxysteroid dehydrogenase). Estrone Sulfate (E1S) is the most abundant circulating estrogen in non-pregnant women as well as normal men. Estrone is primarily synthesized from estrone sulfate. Estrone is an estrogenic hormone secreted by the ovaries and adipose tissues. Estrone is one of the three estrogens found in humans. The other two are estriol and estradiol. Estrone is the least prevalent of the three. Estradiol plays a critical role on reproductive and sexual functioning in women and it also affects other organs including the bones. Estriol is an estrogen that is prevalent primarily during pregnancy. C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C483 - Therapeutic Estrogen D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones
Prodiamine
CONFIDENCE standard compound; INTERNAL_ID 498; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5592; ORIGINAL_PRECURSOR_SCAN_NO 5591 CONFIDENCE standard compound; INTERNAL_ID 498; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5630; ORIGINAL_PRECURSOR_SCAN_NO 5629 CONFIDENCE standard compound; INTERNAL_ID 498; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5608; ORIGINAL_PRECURSOR_SCAN_NO 5607 CONFIDENCE standard compound; INTERNAL_ID 498; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5607; ORIGINAL_PRECURSOR_SCAN_NO 5606 CONFIDENCE standard compound; INTERNAL_ID 498; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5619; ORIGINAL_PRECURSOR_SCAN_NO 5616 CONFIDENCE standard compound; INTERNAL_ID 498; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5615; ORIGINAL_PRECURSOR_SCAN_NO 5612
Vomilenine
C21H22N2O3 (350.16303419999997)
An indole alkaloid that is vinorine bearing a hydroxy substituent at position 21.
cathenamine
C21H22N2O3 (350.16303419999997)
A yohimban alkaloid with formula C21H22N2O3, produced by Catharanthus roseus and Rauvolfia serpentina plant species.
Perakine
C21H22N2O3 (350.16303419999997)
An indole alkaloid having a ajmalan-type skeleton and characterised by a 17alpha-acetoxy group, a 21beta-methyl group, loss of the 1-methyl group with associated unsaturation at N(1)=C(2), and a 20alpha-formyl group in place of the 20beta-ethyl side-chain. Raucaffrine is a natural product found in Rauvolfia serpentina and Rauvolfia sprucei with data available. Perakine?is an indole alkaloid with anti-inflammatory activities[1].
Safranin
C20H19ClN4 (350.12981640000004)
D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents D004396 - Coloring Agents
BML 284
C19H18N4O3 (350.13788380000005)
Chloromarmin
C19H23ClO4 (350.12847880000004)
Chloromarmin is found in fruits. Chloromarmin is a constituent of Aegle marmelos (bael fruit). Constituent of Aegle marmelos (bael fruit). Chloromarmin is found in fruits.
Moschamindole
Isolated from safflower meal (Carthamus tinctorius). Moschamindole is found in safflower, fats and oils, and herbs and spices. Moschamindole is found in fats and oils. Moschamindole is isolated from safflower meal (Carthamus tinctorius).
Eremopetasin sulfoxide
Eremopetasin sulfoxide is found in green vegetables. Eremopetasin sulfoxide is a constituent of Petasites japonicus (sweet coltsfoot) Constituent of Petasites japonicus (sweet coltsfoot). Eremopetasin sulfoxide is found in green vegetables.
Na-p-Hydroxycoumaroyltryptophan
Na-p-Hydroxycoumaroyltryptophan is found in coffee and coffee products. Na-p-Hydroxycoumaroyltryptophan is a constituent of green coffee beans (Coffea canephora var. robusta) (Rubiaceae). Constituent of green coffee beans (Coffea canephora variety robusta) (Rubiaceae). Na-p-Hydroxycoumaroyltryptophan is found in coffee and coffee products.
N4-(1,3-Benzodioxol-5-ylmethyl)-6-(3-methoxyphenyl)pyrimidine-2,4-diamine
C19H18N4O3 (350.13788380000005)
Sulfuric acid [(13S)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] ester
C18H22O5S (350.11878820000004)
Strychnine N-oxide
C21H22N2O3 (350.16303419999997)
Paquinimod
C21H22N2O3 (350.16303419999997)
C308 - Immunotherapeutic Agent
Benzylpenicilloyl
C17H22N2O4S (350.13002120000004)
Sibopirdine
polyneuridine aldehyde
C21H22N2O3 (350.16303419999997)
Polyneuridine aldehyde is a member of the class of compounds known as macroline alkaloids. Macroline alkaloids are alkaloids with a structure that is based on the tetracyclic macroline skeleton. The macroline skeleton arises by scission of the C-21 to N-4 bond of the akuammilan skeleton, and mostly occurs in bisindole alkaloids. Polyneuridine aldehyde is practically insoluble (in water) and an extremely weak acidic compound (based on its pKa). Polyneuridine aldehyde can be found in a number of food items such as allspice, peach, italian sweet red pepper, and orange bell pepper, which makes polyneuridine aldehyde a potential biomarker for the consumption of these food products.
Strychnine N-Oxide
C21H22N2O3 (350.16303419999997)
A tertiary amine oxide resulting from the oxidation of the non-acylated nitrogen of strychnine. It is a metabolite of strychnine.
(E)-2-Methoxy-6,6-dimethylchromeno-[2,3:4,3]-9-methoxychalcone
Arundinin
Arundinin is a natural product found in Pleione bulbocodioides, Pleione yunnanensis, and other organisms with data available.
Corydamine
Corydamine is a natural product found in Hypecoum erectum, Fumaria officinalis, and other organisms with data available.
6-Hydroxy-3-methylthio-3-<4-(3-methyl-2-butenoxy)phenylmethyl>-2,5-piperazinedione|6-Hydroxy-3-methylthio-3-[4-(3-methyl-2-butenoxy)phenylmethyl]-2,5-piperazinedione|6-Hydroxy-3-[4-(3-methyl-2-butenylloxy)-phenylmethyl]-3-(methylthio)-2,5-piperazinedione
C17H22N2O4S (350.13002120000004)
1,5,6-TRI-O-ACETYL-2,3,4-TRI-O-METHYLHEXITOL (1-D)
6-(3,4-Dimethoxy-phenyl)-5-hydroxy-5,6-dihydro-3H-benzo[c][2,7]naphthyridin-4-on|6-(3,4-dimethoxy-phenyl)-5-hydroxy-5,6-dihydro-3H-benzo[c][2,7]naphthyridin-4-one|Perlolin|perloline
(2R,4S,5R,8S,10R)-2-{[(Z)-3-(methylsulfanyl)prop-2-enoyl]oxy}eremophil-7(11)-en-12,8-olide|(8S)-2-{[(Z)-3-(methylsulfanyl)prop-2-enoyl]oxy}eremophil-7(11)-en-12,8-olide
2H-pyran-[2,3:5,6]-1,6,7-trihydroxy-9-10-dihydrophenanthrene|paralycolin B
2-(4-Hydroxy-3,5-dimethoxyphenyl)-1-(4-hydroxy-3-methoxyphenyl)-1,3-propanediol
1S,2R,3R,4S-1-ethoxy-2-[(benzoyloxy)methyl]cyclohex-5-ene-2,3,4-triol 3-acetate
erythro-1-(3-hydroxy-5-methoxyphenyl)-2-(4-hydroxy-3,5-dimethoxyphenyl)-1,3-propanediol|sapnol A
3,3-dihydroxy-2-(p-hydroxybenzyl)-5-methoxybibenzyl
3,3-dihydroxy-4-(p-hydroxybenzyl)-5-methoxybibenzyl
(2S)-5,7-dimethoxy-8-(3-methylbut-1,3-dienyl)flavanone|tephroleocarpin B 5-methyl ether
3,5-dihydroxy-2-(p-hydroxybenzyl)-3-methoxybibenzyl
2-O-beta-D-glucopyranosyl eucommiol|eucommioside|Eucommioside I|EucommiosideI
(2S)-2-amino-5-{[(Z)-3-(4-hydroxyphenyl)-2-methoxy-2-propenoyl]amino}{[(imino)methyl]amino}pentanoic acid
Millepachine
Millepachine is a bioactive natural chalcone from Chinese herbal medicine Millettia pachycarpa Benth, exhibits strong antitumor effects against numerous human cancer cells both in vitro and in vivo[1].
Isoarundinin II
Isoarundinin II is a natural product found in Pleione bulbocodioides, Pleione yunnanensis, and other organisms with data available.
Ranitidine hydrochloride
C13H23ClN4O3S (350.11793180000006)
D018377 - Neurotransmitter Agents > D018494 - Histamine Agents > D006633 - Histamine Antagonists D005765 - Gastrointestinal Agents > D000897 - Anti-Ulcer Agents Ranitidine hydrochloride is a potent, selective and orally active histamine H2-receptor antagonist with an IC50 of 3.3 μM that inhibits gastric secretion. Ranitidine hydrochloride is a weak inhibitor of CYP2C19 and CYP2C9[1][2].
7-(5,7-dimethoxy-4-oxochromen-2-yl)-6-hydroxyheptanoic acid
5-chloro-3-[(1E,3E)-3,5-dimethylhepta-1,3-dienyl]-7,8-dihydroxy-7-methyl-8H-isochromen-6-one
C19H23ClO4 (350.12847880000004)
Estrone-3-sulfate
C18H22O5S (350.11878820000004)
CONFIDENCE Reference Standard (Level 1); INTERNAL_ID 8326
5-chloro-3-[(1E,3E)-3,5-dimethylhepta-1,3-dienyl]-7,8-dihydroxy-7-methyl-8H-isochromen-6-one [IIN-based: Match]
C19H23ClO4 (350.12847880000004)
5-chloro-3-[(1E,3E)-3,5-dimethylhepta-1,3-dienyl]-7,8-dihydroxy-7-methyl-8H-isochromen-6-one [IIN-based on: CCMSLIB00000846396]
C19H23ClO4 (350.12847880000004)
7-(5,7-dimethoxy-4-oxochromen-2-yl)-6-hydroxyheptanoic acid [IIN-based on: CCMSLIB00000845870]
7-(5,7-dimethoxy-4-oxochromen-2-yl)-6-hydroxyheptanoic acid [IIN-based: Match]
9,9-Bis(4-hydroxyphenyl)fluorene
CONFIDENCE standard compound; INTERNAL_ID 619; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5172; ORIGINAL_PRECURSOR_SCAN_NO 5167 CONFIDENCE standard compound; INTERNAL_ID 619; DATASET 20200303_ENTACT_RP_MIX506; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 5139; ORIGINAL_PRECURSOR_SCAN_NO 5136
2-(4-(tert-Butyl)phenoxy)cyclohexyl prop-2-yn-1-yl sulfite
Ala Ala Cys Ser
Ala Ala Ser Cys
Ala Cys Ala Ser
Ala Cys Gly Thr
Ala Cys Ser Ala
Ala Cys Thr Gly
Ala Gly Cys Thr
Ala Gly Thr Cys
Ala Ser Ala Cys
Ala Ser Cys Ala
Ala Ser Ser Ser
Ala Thr Cys Gly
Ala Thr Gly Cys
Cys Ala Ala Ser
Cys Ala Gly Thr
Cys Ala Ser Ala
Cys Ala Thr Gly
Cys Gly Ala Thr
Cys Gly Thr Ala
Cys Ser Ala Ala
Cys Thr Ala Gly
Cys Thr Gly Ala
Gly Ala Cys Thr
Gly Ala Thr Cys
Gly Cys Ala Thr
Gly Cys Thr Ala
Gly Gly Met Ser
Gly Gly Ser Met
Gly Met Gly Ser
Gly Met Ser Gly
Gly Ser Gly Met
Gly Ser Met Gly
Gly Ser Ser Thr
Gly Ser Thr Ser
Gly Thr Ala Cys
Gly Thr Cys Ala
Gly Thr Ser Ser
Met Gly Gly Ser
Met Gly Ser Gly
Met Ser Gly Gly
Ser Ala Ala Cys
Ser Ala Cys Ala
Ser Ala Ser Ser
Ser Cys Ala Ala
Ser Gly Gly Met
Ser Gly Met Gly
Ser Gly Ser Thr
Ser Gly Thr Ser
Ser Met Gly Gly
Ser Ser Ala Ser
Ser Ser Gly Thr
Ser Ser Ser Ala
Ser Ser Thr Gly
Ser Thr Gly Ser
Ser Thr Ser Gly
Thr Ala Cys Gly
Thr Ala Gly Cys
Thr Cys Ala Gly
Thr Cys Gly Ala
Thr Gly Ala Cys
Thr Gly Cys Ala
Thr Gly Ser Ser
Thr Ser Gly Ser
Thr Ser Ser Gly
Eremopetasin sulfoxide
Moschamindole
Na-p-Hydroxycoumaroyltryptophan
Chloromarmin
C19H23ClO4 (350.12847880000004)
estrone sulfate
C18H22O5S (350.11878820000004)
C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C483 - Therapeutic Estrogen D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones
4-chloro-6-methoxy-7-[3-(4-methylpiperazin-1-yl)propoxy]quinazoline
3,6-dimethyl-1-N,4-N-diphenyl-1,2,4,5-tetrazine-1,4-dicarboxamide
(R,R)-(+)-BIS(ALPHA-METHYLBENZYL)AMINEHYDROCHLORIDE
4-(2-CYANO-BENZENESULFONYL)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
C17H22N2O4S (350.13002120000004)
4-(3-CYANO-BENZENESULFONYL)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
C17H22N2O4S (350.13002120000004)
3-(4-CYANO-BENZENESULFONYL)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
C17H22N2O4S (350.13002120000004)
bis-(Acetylactonate) ethoxide isopropoxide titanium
5-DIMETHYLAMINONAPHTHALENE-1-SULFONYL-L-VALINE
C17H22N2O4S (350.13002120000004)
(1S,3S)-1-(1,3-Benzodioxol-5-yl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic Acid Methyl Ester
3-(2-CYANO-BENZENESULFONYL)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
C17H22N2O4S (350.13002120000004)
3-(3-CYANO-BENZENESULFONYL)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
C17H22N2O4S (350.13002120000004)
TERT-BUTYL [2-PHTHALIMIDO-1-(METHYLSULFANYLMETHYL)ETHYL]CARBAMATE
C17H22N2O4S (350.13002120000004)
4-DIMETHYLAMINO-7-(4-ETHYL-PHENYL)-7H-9-THIA-1,5,7-TRIAZA-FLUOREN-8-ONE
C19H18N4OS (350.12012580000004)
(1R,3S)-1-(1,3-Benzodioxol-5-yl)-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole-3-carboxylic Acid Methyl Ester
ETHYL 4-(4-METHOXYPHENYL)-2-OXO-6-PHENYL-3-CYCLOHEXENE-1-CARBOXYLATE
(E)-6-Nitro-3-(2-(pyridin-2-yl)vinyl)-1-(tetrahydro-2H-pyran-2-yl)-1H-indazole
C19H18N4O3 (350.13788380000005)
2-[1-(2-fluorobenzyl)-1H-pyrazolo[3,4-b]pyridin-3-yl]pyrimidine-4,5,6-triamine
C17H15FN8 (350.14036419999996)
N-methyl-3-(2,3,4,5,6-pentadeuteriophenyl)-3-[4-(trifluoromethyl)phenoxy]propan-1-amine,hydrochloride
C17H14D5ClF3NO (350.14210489000004)
Clomipramine HCl
C19H24Cl2N2 (350.13164439999997)
D018377 - Neurotransmitter Agents > D018490 - Serotonin Agents > D017367 - Selective Serotonin Reuptake Inhibitors C78272 - Agent Affecting Nervous System > C265 - Antidepressant Agent > C94727 - Tricyclic Antidepressant D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D000928 - Antidepressive Agents D018377 - Neurotransmitter Agents > D014179 - Neurotransmitter Uptake Inhibitors D049990 - Membrane Transport Modulators
ethoxybis(pentane-2,4-dionato-O,O)(propan-2-olato)titanium
4-(6-ACETYL-1,3,7-TRIMETHYL-2,4-DIOXO-1,2,3,4,5,8-HEXAHYDROPYRIDO[2,3-D]PYRIMIDIN-5-YL)BENZONITRILE
C19H18N4O3 (350.13788380000005)
(1R,2S,3R)-(+)-3-[N-(BENZENESULFONYL)-N-(3,5-DIMETHYL-PHENYL)AMINO]-2-BORNANOL
N-Acetyl-9-(acetylaMino)-9-deoxyneuraMinic Acid
C13H22N2O9 (350.13252420000003)
4-(4-CYANO-BENZENESULFONYL)-PIPERIDINE-1-CARBOXYLIC ACID TERT-BUTYL ESTER
C17H22N2O4S (350.13002120000004)
4-METHOXY-N-(4-METHOXYPHENYL)-N-(4-NITROPHENYL)ANILINE
dimethyl 2,6-dimethyl-4-(2,3,4,5-tetradeuterio-6-nitrophenyl)-1,4-dihydropyridine-3,5-dicarboxylate
N-(2,4-dimethylphenyl)-2,2,2-trifluoro-N-[(E)-(3-methoxyphenyl)methylideneamino]acetamide
C18H17F3N2O2 (350.12420579999997)
Raxatrigine hydrochloride
C78272 - Agent Affecting Nervous System > C241 - Analgesic Agent
2-(4-nitrophenyl)-N-(2-oxolanylmethyl)-4-quinazolinamine
C19H18N4O3 (350.13788380000005)
N-[(E)-[(E)-3-(2-methoxyphenyl)prop-2-enylidene]amino]-5-(5-methylfuran-2-yl)-1H-pyrazole-3-carboxamide
C19H18N4O3 (350.13788380000005)
4-(2,3-Dihydro-1,4-benzodioxin-6-ylamino)-3-quinolinecarboxylic acid ethyl ester
N-[5-(1-naphthylmethyl)-1,3-thiazol-2-yl]cyclohexanecarboxamide
2-(2-Hydroxyphenyl)-4-phenyl-5,6-dihydrobenzo[h]quinazoline
C24H18N2O (350.14190579999996)
Bis(trimethylsilyl) 2-[(trimethylsilyl)oxy]succinate
Rel-(3AR,4S,7R,7AS)-3A,4,7,7A-tetrahydro-2-(4-nitro-1-naphthalenyl)-4,7-ethano-1H-isoindole-1,3(2H)-dione
Benzo(g)-1,3-benzodioxolo(5,6-a)quinolizinium, 5,6-dihydro-9,10-dimethoxy-13-methyl-
C21H20NO4+ (350.13922600000006)
5,5-Dimethyl-2-[2-oxo-1-[(2-phenylacetyl)amino]propyl]-1,3-thiazolidine-4-carboxylic acid
C17H22N2O4S (350.13002120000004)
[3-Carboxy-2-[5-(dithiolan-3-yl)pentanoyloxy]propyl]-trimethylazanium
Alquen
C13H23ClN4O3S (350.11793180000006)
D018377 - Neurotransmitter Agents > D018494 - Histamine Agents > D006633 - Histamine Antagonists D005765 - Gastrointestinal Agents > D000897 - Anti-Ulcer Agents
Ehretianone
An organic heterotetracyclic compound that is 9,9a-dihydro-9,4a-prop[1]enoxanthene-1,4-dione substituted by a hydroxy group at position 7, a methyl group at position 12 and a prenyl group at position 9a. Isolated from the root barks of Ehretia buxifolia, it exhibits antisnake venom activity.
Sulfuric acid [(13S)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] ester
C18H22O5S (350.11878820000004)
N-{amino[(6-methoxy-4-methyl-2-quinazolinyl)amino]methylene}-N-phenylurea
3-(1H-indol-3-yl)-N-[(1E)-1-(3-nitrophenyl)ethylidene]propanohydrazide
C19H18N4O3 (350.13788380000005)
6-(3,5-dimethyl-4-isoxazolyl)-N-[(3-methyl-2-thiophenyl)methyl]-4-quinazolinamine
C19H18N4OS (350.12012580000004)
[1-(2-Phenoxyethyl)-3-indolyl]-(1-pyrrolidinyl)methanethione
5-Benzyl-2,2-dimethyl-5-(4-vinylbenzyl)-1,3-dioxane-4,6-dione
2-[[oxo-(2-oxo-1H-quinolin-4-yl)methyl]amino]-3-phenylpropanoic acid methyl ester
7-Amino-9-(phenacylthio)-8-azaspiro[4.5]deca-6,9-diene-6,10-dicarbonitrile
C19H18N4OS (350.12012580000004)
3-(2,3-dimethyl-1H-indol-5-yl)-4-(3-methoxyphenyl)-1H-1,2,4-triazole-5-thione
C19H18N4OS (350.12012580000004)
3-[5-(4-Fluorophenyl)-7-phenyl-1,7-dihydro-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl]-1-propanol
methyl 2-{5-[(1-isopropyl-2,5-dimethyl-1H-pyrrol-3-yl)methylene]-2,4-dioxo-1,3-thiazolidin-3-yl}propanoate
C17H22N2O4S (350.13002120000004)
N-butyl-4-[(Z)-(4-methyl-3-oxo-3,4-dihydro-2H-1,4-benzoxazin-2-ylidene)methyl]benzamide
C21H22N2O3 (350.16303419999997)
Isostrychnine N-oxide
C21H22N2O3 (350.16303419999997)
A monoterpenoid indole alkaloid with formula C21H22N2O3, originally isolated from the seeds of Strychnos nux-vomica.
(5E)-6-hydroxy-3-phenyl-5-[1-(2-phenylhydrazinyl)propylidene]pyrimidine-2,4(3H,5H)-dione
C19H18N4O3 (350.13788380000005)
Nonanedioic acid monoglycoside
A dicarboxylic acid monoester resulting from the formal condensation of the carboxy group of nonanedioic acid with the hydroxy group of hexopyranose.
2-cyclopropyl-N-[(2R,3R,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]-3,6-dihydro-2H-pyran-3-yl]acetamide
C15H21F3N2O4 (350.14533420000004)
2-cyclopropyl-N-[(2S,3S,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]-3,6-dihydro-2H-pyran-3-yl]acetamide
C15H21F3N2O4 (350.14533420000004)
2-cyclopropyl-N-[(2R,3R,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]-3,6-dihydro-2H-pyran-3-yl]acetamide
C15H21F3N2O4 (350.14533420000004)
2-cyclopropyl-N-[(2R,3S,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]-3,6-dihydro-2H-pyran-3-yl]acetamide
C15H21F3N2O4 (350.14533420000004)
2-cyclopropyl-N-[(2S,3R,6S)-2-(hydroxymethyl)-6-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]-3,6-dihydro-2H-pyran-3-yl]acetamide
C15H21F3N2O4 (350.14533420000004)
2-cyclopropyl-N-[(2S,3S,6R)-2-(hydroxymethyl)-6-[2-oxo-2-(2,2,2-trifluoroethylamino)ethyl]-3,6-dihydro-2H-pyran-3-yl]acetamide
C15H21F3N2O4 (350.14533420000004)
7-(5,7-Dimethoxy-4-oxochromen-2-yl)-6-hydroxyheptanoic acid
2-(1,3-benzodioxol-5-ylamino)-N-[(E)-(2-methyl-1H-indol-3-yl)methylidene]acetohydrazide (non-preferred name)
C19H18N4O3 (350.13788380000005)
9-deoxy-9-acetamido-N-acetyl-alpha-neuraminic acid
C13H22N2O9 (350.13252420000003)
(2S)-4-amino-2-[[(2S)-2-[[(2S)-2-amino-3-phenylpropanoyl]amino]propanoyl]amino]-4-oxobutanoic acid
(1R,2S,4aR,4bR,7R,9aR,10S,10aR)-2-chloro-1-methyl-8-methylidene-13-oxododecahydro-4a,1-(epoxymethano)-7,9a-methanobenzo[a]azulene-10-carboxylic acid
C19H23ClO4 (350.12847880000004)
sulfuric acid [(8R,9R,13S,14R)-13-methyl-17-oxo-7,8,9,11,12,14,15,16-octahydro-6H-cyclopenta[a]phenanthren-3-yl] ester
C18H22O5S (350.11878820000004)
N-[4-[2-[(2E)-2-(1-phenylethylidene)hydrazinyl]-1,3-thiazol-4-yl]phenyl]acetamide
C19H18N4OS (350.12012580000004)
(4aR,5aR,8aS,13aS,15bR)-5a-hydroxy-2,4a,5,7,8,13a,15,15a,15b,16-decahydro4,6-methanoindolo[3,2,1-ij]oxepino[2,3,4-de]pyrrolo[2,3-h]quinolin-14-one
C21H22N2O3 (350.16303419999997)
3,8,9-trimethoxy-5-methyl-5H-benzo[c]phenanthridin-5-ium-2-one
C21H20NO4+ (350.13922600000006)
D000970 - Antineoplastic Agents
(2,6-Diacetyloxy-6-deuterio-3,4,5-trimethoxyhexyl) acetate
5-chloro-3-[(1E,3E)-3,5-dimethylhepta-1,3-dienyl]-7,8-dihydroxy-7-methyl-8H-isochromen-6-one
C19H23ClO4 (350.12847880000004)
4,5-Diphenyl-6-styryl-1,2-dihydropyrimidin-2-one
C24H18N2O (350.14190579999996)
2-Methyl-4-oxo-8-[1-imidazolyl(thiocarbonyl)oxy]decahydronaphthalene-1-carboxylic acid methyl ester
C17H22N2O4S (350.13002120000004)
(2,5-Diacetyloxy-1-deuterio-3,4,6-trimethoxyhexyl) acetate
estrone 3-sulfate
C18H22O5S (350.11878820000004)
A steroid sulfate that is the 3-sulfate of estrone.
(1r,8r,9s,11s,12r)-3,6-dihydroxy-16-methyl-11-(prop-1-en-2-yl)pentacyclo[6.6.3.1⁹,¹².0¹,⁹.0²,⁷]octadeca-2,4,6,16-tetraene-14,18-dione
3-[2-(3-hydroxyphenyl)ethyl]-4-[(4-hydroxyphenyl)methyl]-5-methoxyphenol
7-[(7-chloro-6-hydroxy-3,7-dimethyloct-2-en-1-yl)oxy]chromen-2-one
C19H23ClO4 (350.12847880000004)
5,5,13-trimethyl-4-(3-oxobutanoyl)-4,13-diazatetracyclo[6.6.1.0²,⁶.0¹²,¹⁵]pentadeca-1,6,8,10,12(15)-pentaene-3,14-dione
methyl (1s,12s,13r,14r,15e)-15-ethylidene-13-formyl-3,17-diazapentacyclo[12.3.1.0²,¹⁰.0⁴,⁹.0¹²,¹⁷]octadeca-2(10),4,6,8-tetraene-13-carboxylate
C21H22N2O3 (350.16303419999997)
methyl (1s,12s,14r,15e)-15-ethylidene-13-formyl-3,17-diazapentacyclo[12.3.1.0²,¹⁰.0⁴,⁹.0¹²,¹⁷]octadeca-2(10),4,6,8-tetraene-13-carboxylate
C21H22N2O3 (350.16303419999997)
2-{2-[4,5-bis(hydroxymethyl)-6-oxabicyclo[3.1.0]hexan-1-yl]ethoxy}-6-(hydroxymethyl)oxane-3,4,5-triol
(1r,9s,10r,11r,17s)-8,12-diacetyl-8,14-diazapentacyclo[9.5.2.0¹,⁹.0²,⁷.0¹⁴,¹⁷]octadeca-2,4,6,12-tetraene-10-carbaldehyde
C21H22N2O3 (350.16303419999997)
(6s)-2,2-dimethyl-6-(prop-1-en-2-yl)-6,7-dihydro-1-oxatetraphene-5,8,9-triol
(1r,2s)-1-(acetyloxy)-1-(7-methoxy-2h-1,3-benzodioxol-5-yl)propan-2-yl (2z)-2-methylbut-2-enoate
methyl 2-[(2r,4r,6r)-2-(7-methoxy-6-methyl-1-oxo-3h-2-benzofuran-4-yl)-6-methyl-1,3-dioxan-4-yl]acetate
[(1r,2s,5s,6r)-6-(acetyloxy)-2-ethoxy-1,5-dihydroxycyclohex-3-en-1-yl]methyl benzoate
6-hydroxy-12-oxa-8,17-diazaheptacyclo[15.5.2.0¹,¹⁸.0²,⁷.0⁸,²².0¹¹,²¹.0¹⁵,²⁰]tetracosa-2,4,6,14-tetraen-9-one
C21H22N2O3 (350.16303419999997)
(2s)-2-amino-5-[({[(2z)-1-hydroxy-3-(4-hydroxyphenyl)-2-methoxyprop-2-en-1-ylidene]amino}methanimidoyl)amino]pentanoic acid
(3s,4s)-3-(4-hydroxy-3-methoxyphenyl)-2-oxa-6,11-diazatetracyclo[7.5.2.0⁴,¹⁵.0¹²,¹⁶]hexadeca-1(14),5,9,12,15-pentaen-5-ol
5,10-dihydroxy-12-isopropyl-1,6-dimethyl-3,8,13-trioxapentacyclo[7.6.1.0²,⁴.0⁶,¹⁶.0¹¹,¹⁵]hexadec-11(15)-ene-7,14-dione
methyl (13z)-13-ethylidene-18-formyl-8,15-diazapentacyclo[10.5.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵]octadeca-2,4,6,8-tetraene-18-carboxylate
C21H22N2O3 (350.16303419999997)
7-methoxy-8-[(1e)-3-methoxy-3-methylbut-1-en-1-yl]-2-phenylchromen-4-one
(1r,10s,12r,13r,14s,16s,17s,18r)-13-formyl-14-methyl-8,15-diazahexacyclo[14.2.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵.0¹²,¹⁷]nonadeca-2,4,6,8-tetraen-18-yl acetate
C21H22N2O3 (350.16303419999997)
(2r,3r,4s,5s,6r)-2-{[(1r,2r)-2-(2-hydroxyethyl)-3,4-bis(hydroxymethyl)cyclopent-3-en-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
1,6-bis(acetyloxy)-3,4,5-trimethoxyhexan-2-yl acetate
methyl (2r,12bs)-2-[(2z)-1-oxobut-2-en-2-yl]-1h,2h,6h,7h,12h,12bh-indolo[2,3-a]quinolizine-3-carboxylate
C21H22N2O3 (350.16303419999997)
[7-(2h-1,3-benzodioxol-5-yl)tetracyclo[8.2.1.0³,¹².0⁶,¹¹]trideca-4,8-dien-2-yl]acetic acid
8,12-diacetyl-8,14-diazapentacyclo[9.5.2.0¹,⁹.0²,⁷.0¹⁴,¹⁷]octadeca-2,4,6,12-tetraene-10-carbaldehyde
C21H22N2O3 (350.16303419999997)
3,8,10-trihydroxy-6-methoxy-3-methyl-9-oxo-1,2,4,4a,9a,10-hexahydroanthracen-2-yl acetate
4-[[4-[[4-(methoxymethyl)phenoxy]methyl]phenoxy]methyl]phenol
{"Ingredient_id": "HBIN009916","Ingredient_name": "4-[[4-[[4-(methoxymethyl)phenoxy]methyl]phenoxy]methyl]phenol","Alias": "NA","Ingredient_formula": "C22H22O4","Ingredient_Smile": "NA","Ingredient_weight": "350.41","OB_score": "NA","CAS_id": "210969-95-2","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7870","PubChem_id": "NA","DrugBank_id": "NA"}
methyl (2s,12bs)-2-[(2z)-1-oxobut-2-en-2-yl]-1h,2h,6h,7h,12h,12bh-indolo[2,3-a]quinolizine-3-carboxylate
C21H22N2O3 (350.16303419999997)
3,6-dihydroxy-15-methyl-9-(3-methylbut-2-en-1-yl)tetracyclo[6.5.3.0¹,⁹.0²,⁷]hexadeca-2,4,6,11,15-pentaene-10,13-dione
(11s,18s,20r,21r,22s)-6-hydroxy-12-oxa-8,17-diazaheptacyclo[15.5.2.0¹,¹⁸.0²,⁷.0⁸,²².0¹¹,²¹.0¹⁵,²⁰]tetracosa-2,4,6,14-tetraen-9-one
C21H22N2O3 (350.16303419999997)
[(1s,2s,3r,6r,7r,10s,11s,12s)-7-(2h-1,3-benzodioxol-5-yl)tetracyclo[8.2.1.0³,¹².0⁶,¹¹]trideca-4,8-dien-2-yl]acetic acid
(1r,11s,18s,20r,21r,22s)-4-hydroxy-12-oxa-8,17-diazaheptacyclo[15.5.2.0¹,¹⁸.0²,⁷.0⁸,²².0¹¹,²¹.0¹⁵,²⁰]tetracosa-2,4,6,14-tetraen-9-one
C21H22N2O3 (350.16303419999997)
(1s,11s,18r,20r,21r,22s)-18-hydroxy-12-oxa-8,17-diazaheptacyclo[15.5.2.0¹,¹⁸.0²,⁷.0⁸,²².0¹¹,²¹.0¹⁵,²⁰]tetracosa-2,4,6,14-tetraen-9-one
C21H22N2O3 (350.16303419999997)
(12r,14s,15s,16s)-11,16-dimethyl-20-oxo-17-oxa-1,11-diazapentacyclo[10.8.1.0²,⁷.0⁸,²¹.0¹⁴,¹⁹]henicosa-2,4,6,8(21),18-pentaene-15-carbaldehyde
C21H22N2O3 (350.16303419999997)
(1r,2r,8ar)-1,8a-dimethyl-6-oxo-7-(propan-2-ylidene)-2,3,4,8-tetrahydro-1h-naphthalen-2-yl (2e)-3-[(s)-methanesulfinyl]prop-2-enoate
7-methoxy-8-(3-methoxy-3-methylbut-1-en-1-yl)-2-phenylchromen-4-one
2-amino-5-({[3-(4-hydroxyphenyl)-2-methoxyprop-2-enamido]methanimidoyl}amino)pentanoic acid
2-hydroxy-2,11-dimethyl-6-methylidene-7-oxo-8,12,13-trioxatetracyclo[9.2.2.0¹,¹⁰.0⁵,⁹]pentadec-14-en-4-yl propanoate
(3s)-6-(4,6-dimethoxy-7-methyl-3-oxo-1h-2-benzofuran-5-yl)-3-hydroxy-4-methylhex-4-enoic acid
19-ethyl-19-hydroxy-17-oxa-3,13-diazapentacyclo[11.8.0.0²,¹¹.0⁴,⁹.0¹⁵,²⁰]henicosa-1(21),4,6,8,10,15(20)-hexaene-14,18-dione
methyl 6-(1,4-dihydroxy-6-methoxy-7-methyl-3-oxo-1h-2-benzofuran-5-yl)-4-methylhex-4-enoate
3-(4-hydroxy-3-methoxyphenyl)-2-oxa-6,11-diazatetracyclo[7.5.2.0⁴,¹⁵.0¹²,¹⁶]hexadeca-1(14),5,9,12,15-pentaen-5-ol
(1r,2r,8ar)-1,8a-dimethyl-6-oxo-7-(propan-2-ylidene)-2,3,4,8-tetrahydro-1h-naphthalen-2-yl (2z)-3-[(r)-methanesulfinyl]prop-2-enoate
6-(4,6-dimethoxy-7-methyl-3-oxo-1h-2-benzofuran-5-yl)-3-hydroxy-4-methylhex-4-enoic acid
(1s,8s,9s)-3,6-dihydroxy-15-methyl-9-(3-methylbut-2-en-1-yl)tetracyclo[6.5.3.0¹,⁹.0²,⁷]hexadeca-2,4,6,11,15-pentaene-10,13-dione
(2r,3s,4as,9as,10r)-3,8,10-trihydroxy-6-methoxy-3-methyl-9-oxo-1,2,4,4a,9a,10-hexahydroanthracen-2-yl acetate
3-methoxy-3-(5-methoxy-2,2-dimethylchromen-6-yl)-1-phenylprop-2-en-1-one
5-({3,5,8-trimethyl-2h,3h-azuleno[6,5-b]furan-7-yl}methyl)benzene-1,2,3-triol
1-(acetyloxy)-1-(7-methoxy-2h-1,3-benzodioxol-5-yl)propan-2-yl 2-methylbut-2-enoate
(7s,8r)-5-chloro-3-[(1e,3e,5r)-3,5-dimethylhepta-1,3-dien-1-yl]-7,8-dihydroxy-7-methyl-8h-isochromen-6-one
C19H23ClO4 (350.12847880000004)
(4ar,5s,7r,8as,9r)-9-hydroxy-3,4a,5-trimethyl-4h,5h,6h,7h,8h,8ah,9h-naphtho[2,3-b]furan-7-yl (2z)-3-(methylsulfanyl)prop-2-enoate
[(6r,8s,9ar,9br)-8-(acetyloxy)-6-hydroxy-9-methylidene-2-oxo-4h,5h,5ah,6h,7h,8h,9ah,9bh-naphtho[1,2-b]furan-3-yl]methyl acetate
5-hydroxy-3,6-bis[(4-methoxyphenyl)methylidene]-1h-pyrazin-2-one
(2z)-3-methoxy-3-(5-methoxy-2,2-dimethylchromen-6-yl)-1-phenylprop-2-en-1-one
(1s,9r,12r,16r)-6-ethyl-13,14,15-trihydroxy-1,12-dimethyl-5,10-dioxatetracyclo[7.6.1.0²,⁷.0¹²,¹⁶]hexadeca-2,6-diene-4,11-dione
16,17-dimethoxy-21-methyl-5,7-dioxa-13λ⁵-azapentacyclo[11.8.0.0²,¹⁰.0⁴,⁸.0¹⁵,²⁰]henicosa-1(13),2,4(8),9,14,16,18,20-octaen-13-ylium
[C21H20NO4]+ (350.13922600000006)
(1r,10s,12r,13e,14s,16s,17s,18r)-13-ethylidene-14-hydroxy-8,15-diazahexacyclo[14.2.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵.0¹²,¹⁷]nonadeca-2,4,6,8-tetraen-18-yl acetate
C21H22N2O3 (350.16303419999997)
19-ethyl-19-hydroxy-17-oxa-3,13-diazapentacyclo[11.8.0.0²,¹¹.0⁴,⁹.0¹⁵,²⁰]henicosa-1(21),2,5,7,10,15(20)-hexaene-14,18-dione
3,6-dihydroxy-16-methyl-11-(prop-1-en-2-yl)pentacyclo[6.6.3.1⁹,¹².0¹,⁹.0²,⁷]octadeca-2,4,6,16-tetraene-14,18-dione
6-hydroxy-16-methyl-10-(3-methylbut-2-en-1-yl)-2-oxatetracyclo[7.5.3.0¹,¹⁰.0³,⁸]heptadeca-3,5,7,12,16-pentaene-11,14-dione
(2r,3r,4s,5s,6r)-2-{2-[(1s,4r,7r)-7-hydroxy-7-(hydroxymethyl)-2-oxabicyclo[2.2.1]heptan-1-yl]ethoxy}-6-(hydroxymethyl)oxane-3,4,5-triol
(1r,2r,8ar)-7-(2-hydroxypropan-2-yl)-1,8a-dimethyl-6-oxo-1,2,3,4-tetrahydronaphthalen-2-yl (2z)-3-(methylsulfanyl)prop-2-enoate
(2r,3r,4r,5s,6r)-2-{2-[(1s,4r,5r)-4,5-bis(hydroxymethyl)-6-oxabicyclo[3.1.0]hexan-1-yl]ethoxy}-6-(hydroxymethyl)oxane-3,4,5-triol
3-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-1h,2h-pyrrolo[2,1-b]quinazolin-9-one
7-{[(6r)-7-chloro-6-hydroxy-3,7-dimethyloct-2-en-1-yl]oxy}chromen-2-one
C19H23ClO4 (350.12847880000004)
3-[2-(3-hydroxyphenyl)ethyl]-2-[(4-hydroxyphenyl)methyl]-5-methoxyphenol
(4r,7r)-4-ethenyl-3-isothiocyanato-4,8,8-trimethyl-14-azatetracyclo[7.6.1.0²,⁷.0¹³,¹⁶]hexadeca-1,9(16),10,12,14-pentaen-15-ol
(3r,6r)-6-(4-hydroxybenzoyl)-3-isopropyl-3,5,6-trimethoxypyrazin-2-ol
9-(2h-1,3-benzodioxol-5-ylmethyl)tetracyclo[8.2.1.0³,¹².0⁶,¹¹]trideca-4,7-diene-7-carboxylic acid
[2-(6-{2h-[1,3]dioxolo[4,5-h]isoquinolin-7-yl}-2h-1,3-benzodioxol-5-yl)ethyl](methyl)amine
(2r,3r,4s,5s,6r)-2-{2-[(1r,5r)-5-hydroxy-2,3-bis(hydroxymethyl)cyclopent-2-en-1-yl]ethoxy}-6-(hydroxymethyl)oxane-3,4,5-triol
7,8,16,18-tetrahydroxy-12-methyl-3,13-dioxatricyclo[13.4.0.0²,⁴]nonadeca-1(19),9,15,17-tetraen-14-one
(3z,6z)-bis[(4-methoxyphenyl)methylidene]pyrazine-2,5-diol
18-hydroxy-12-oxa-8,17-diazaheptacyclo[15.5.2.0¹,¹⁸.0²,⁷.0⁸,²².0¹¹,²¹.0¹⁵,²⁰]tetracosa-2,4,6,14-tetraen-9-one
C21H22N2O3 (350.16303419999997)
(3z,6z)-3-[(4-hydroxyphenyl)methylidene]-5-methoxy-6-[(4-methoxyphenyl)methylidene]pyrazin-2-ol
11,16-dimethyl-20-oxo-17-oxa-1,11-diazapentacyclo[10.8.1.0²,⁷.0⁸,²¹.0¹⁴,¹⁹]henicosa-2,4,6,8(21),18-pentaene-15-carbaldehyde
C21H22N2O3 (350.16303419999997)
2-hydroxy-3-methyl-10-propyl-7,13-dioxatetracyclo[7.5.2.0¹,¹¹.0⁵,⁹]hexadecane-6,8,12,14-tetrone
(2s,19s)-19-ethyl-19-hydroxy-17-oxa-3,13-diazapentacyclo[11.8.0.0²,¹¹.0⁴,⁹.0¹⁵,²⁰]henicosa-1(21),4,6,8,10,15(20)-hexaene-14,18-dione
(1r,13r,15s,16r)-7,9,16-trihydroxy-13-methyl-12,19-dioxatricyclo[13.3.1.0⁵,¹⁰]nonadeca-5,7,9-triene-3,11-dione
methyl 2-(1-oxobut-2-en-2-yl)-1h,2h,6h,7h,12h,12bh-indolo[2,3-a]quinolizine-3-carboxylate
C21H22N2O3 (350.16303419999997)
3-[3-(2-hydroxyethyl)-1h-indol-2-yl]-3-(1h-indol-3-yl)propane-1,2-diol
C21H22N2O3 (350.16303419999997)
2,5,7,15-tetrahydroxy-11-methyl-10,19-dioxatricyclo[14.2.1.0³,⁸]nonadeca-3,5,7,13-tetraen-9-one
1,8a-dimethyl-6-oxo-7-(prop-1-en-2-yl)-1,2,3,4,7,8-hexahydronaphthalen-2-yl 3-methanesulfinylprop-2-enoate
10-(hydroxymethyl)-6-methyl-3-methylidene-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-4-yl 3-hydroxy-2-oxopropanoate
(3s,5z)-3-[3-hydroxy-4-(3-methylbut-2-en-1-yl)phenyl]-5-[(4-hydroxyphenyl)methylidene]oxolan-2-one
2-{[2-(2-hydroxyethyl)-3,4-bis(hydroxymethyl)cyclopent-3-en-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
(1r,18s,20r,21r)-19-hydroxy-12-oxa-8,17-diazaheptacyclo[15.5.2.0¹,¹⁸.0²,⁷.0⁸,²².0¹¹,²¹.0¹⁵,²⁰]tetracosa-2,4,6,14-tetraen-9-one
C21H22N2O3 (350.16303419999997)
(1s,2r,4s,5r,9s,10s,11r)-2-hydroxy-2,11-dimethyl-6-methylidene-7-oxo-8,12,13-trioxatetracyclo[9.2.2.0¹,¹⁰.0⁵,⁹]pentadec-14-en-4-yl propanoate
(2r,3r,4r,5s,6r)-2-{2-[(1s,4r,7r)-7-hydroxy-7-(hydroxymethyl)-2-oxabicyclo[2.2.1]heptan-1-yl]ethoxy}-6-(hydroxymethyl)oxane-3,4,5-triol
(2s,3r,4s,5s,6r)-2-{[(1s,4ar,5s,6r,7r,7as)-5,6,7-trihydroxy-1h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyran-1-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
(1r,10s,12r,13e,16s,17s,18r)-18-(acetyloxy)-13-ethylidene-8,15-diazahexacyclo[14.2.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵.0¹²,¹⁷]nonadeca-2,4,6,8-tetraen-15-ium-15-olate
C21H22N2O3 (350.16303419999997)
(2r,4r,7s,8r,9e,12s)-7,8,16,18-tetrahydroxy-12-methyl-3,13-dioxatricyclo[13.4.0.0²,⁴]nonadeca-1(19),9,15,17-tetraen-14-one
(2r,3r,4s,5s,6r)-2-{2-[(1s,4r,5r)-4,5-bis(hydroxymethyl)-6-oxabicyclo[3.1.0]hexan-1-yl]ethoxy}-6-(hydroxymethyl)oxane-3,4,5-triol
(7r,8r)-5-chloro-3-[(1e,3e)-3,5-dimethylhepta-1,3-dien-1-yl]-7,8-dihydroxy-7-methyl-8h-isochromen-6-one
C19H23ClO4 (350.12847880000004)
(3ar,4s,11ar)-10-(hydroxymethyl)-6-methyl-3-methylidene-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-4-yl 3-hydroxy-2-oxopropanoate
(2r,3r,4s,5r)-1,6-bis(acetyloxy)-3,4,5-trimethoxyhexan-2-yl acetate
(3s,6r)-6-(4-hydroxybenzoyl)-3-isopropyl-3,5,6-trimethoxypyrazin-2-ol
6-(4-hydroxybenzoyl)-3-isopropyl-3,5,6-trimethoxypyrazin-2-ol
(1s,2s,4r,5r,6r,9s,10r,12s,16r)-5,10-dihydroxy-12-isopropyl-1,6-dimethyl-3,8,13-trioxapentacyclo[7.6.1.0²,⁴.0⁶,¹⁶.0¹¹,¹⁵]hexadec-11(15)-ene-7,14-dione
(1r,10r,16s)-13-formyl-14-methyl-8,15-diazahexacyclo[14.2.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵.0¹²,¹⁷]nonadeca-2,4,6,8-tetraen-18-yl acetate
C21H22N2O3 (350.16303419999997)
(1s,2r,18s,19r)-2-hydroxy-8,10-dioxa-4,17-diazaheptacyclo[15.4.3.0¹,¹⁸.0⁴,¹⁹.0⁵,¹³.0⁷,¹¹.0¹⁴,¹⁹]tetracosa-5,7(11),12,14,22-pentaen-3-one
3-[(4-hydroxyphenyl)methylidene]-5-methoxy-6-[(4-methoxyphenyl)methylidene]-1h-pyrazin-2-one
5-chloro-3-[(1e)-3,5-dimethylhepta-1,3-dien-1-yl]-7,8-dihydroxy-7-methyl-8h-isochromen-6-one
C19H23ClO4 (350.12847880000004)
2,3,5-trimethoxy-4-(4-methoxyphenyl)-1,1'-biphenyl
5-[2-(3-hydroxyphenyl)ethyl]-2-[(4-hydroxyphenyl)methyl]-3-methoxyphenol
methyl (1s,16r,18s,20s)-20-ethyl-17-oxa-3,13-diazahexacyclo[11.7.0.0²,¹⁰.0³,¹⁸.0⁴,⁹.0¹⁶,²⁰]icosa-2(10),4,6,8,14-pentaene-18-carboxylate
C21H22N2O3 (350.16303419999997)
8-hydroxy-6-{[(2e)-4-hydroxy-3-methylbut-2-en-1-yl]oxy}-3-methoxy-3,7-dimethyl-1-oxo-4h-2-benzopyran-5-carbaldehyde
4-ethenyl-3-isothiocyanato-4,8,8-trimethyl-14-azatetracyclo[7.6.1.0²,⁷.0¹³,¹⁶]hexadeca-1,9(16),10,12,14-pentaen-15-ol
methyl 12-ethenyl-9-hydroxy-8,16-diazapentacyclo[10.6.1.0¹,¹⁰.0²,⁷.0¹⁶,¹⁹]nonadeca-2,4,6,8,13-pentaene-10-carboxylate
C21H22N2O3 (350.16303419999997)
methyl (1r,19s)-6-methoxy-8,16-diazahexacyclo[10.6.1.1¹⁰,¹².0¹,⁹.0²,⁷.0¹⁶,¹⁹]icosa-2,4,6,8,13-pentaene-10-carboxylate
C21H22N2O3 (350.16303419999997)
4-hydroxy-12-oxa-8,17-diazaheptacyclo[15.5.2.0¹,¹⁸.0²,⁷.0⁸,²².0¹¹,²¹.0¹⁵,²⁰]tetracosa-2,4,6,14-tetraen-9-one
C21H22N2O3 (350.16303419999997)
(1r,8r,9s)-3,6-dihydroxy-15-methyl-9-(3-methylbut-2-en-1-yl)tetracyclo[6.5.3.0¹,⁹.0²,⁷]hexadeca-2,4,6,11,15-pentaene-10,13-dione
3,4a,5-trimethyl-2-oxo-4h,5h,6h,7h,8h,8ah,9h,9ah-naphtho[2,3-b]furan-7-yl 3-(methylsulfanyl)prop-2-enoate
(1s,2r,4s,5r,10s,11r,14s,17r)-11-hydroxy-5-[(1r)-1-hydroxyethyl]-10,14-dimethyl-3,6,16-trioxapentacyclo[8.6.1.0²,⁴.0⁴,⁹.0¹⁴,¹⁷]heptadec-8-ene-7,15-dione
(1s,10s,11r,12s,22r)-9-oxa-4,13-diazahexacyclo[9.8.3.2¹⁰,¹³.0¹,¹².0⁶,²².0¹⁴,¹⁹]tetracosa-6,14,16,18-tetraene-20,23-dione
C21H22N2O3 (350.16303419999997)
(4ar,5s,7r,8ar,9as)-3,4a,5-trimethyl-2-oxo-4h,5h,6h,7h,8h,8ah,9h,9ah-naphtho[2,3-b]furan-7-yl (2z)-3-(methylsulfanyl)prop-2-enoate
18-hydroxy-11-methyl-20-oxo-1,11-diazapentacyclo[10.8.1.0²,⁷.0⁸,²¹.0¹⁴,¹⁹]henicosa-2,4,6,8(21),15-pentaene-15-carbaldehyde
C21H22N2O3 (350.16303419999997)
(1s,11s,17r,18r,20r,21r,22s)-9-oxo-12-oxa-8,17-diazaheptacyclo[15.5.2.0¹,¹⁸.0²,⁷.0⁸,²².0¹¹,²¹.0¹⁵,²⁰]tetracosa-2,4,6,14-tetraen-17-ium-17-olate
C21H22N2O3 (350.16303419999997)
2-hydroxy-7-methoxy-2-propyl-3,4-dihydro-1h-tetracene-5,12-dione
methyl (1r,12r,19s)-12-ethyl-15-oxo-8,16-diazapentacyclo[10.6.1.0¹,⁹.0²,⁷.0¹⁶,¹⁹]nonadeca-2,4,6,9,13-pentaene-10-carboxylate
C21H22N2O3 (350.16303419999997)
(1r,10s,13e,16s)-18-(acetyloxy)-13-ethylidene-8,15-diazahexacyclo[14.2.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵.0¹²,¹⁷]nonadeca-2,4,6,8-tetraen-15-ium-15-olate
C21H22N2O3 (350.16303419999997)
(10s,12s,13e,14r,16s,18r)-13-ethylidene-14-hydroxy-8,15-diazahexacyclo[14.2.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵.0¹²,¹⁷]nonadeca-2,4,6,8-tetraen-18-yl acetate
C21H22N2O3 (350.16303419999997)
methyl 3-ethyl-1-formyl-4-oxo-6h,7h,12h-indolo[2,3-a]quinolizine-2-carboxylate
(7s,8r)-5-chloro-3-[(1e,3z,5s)-3,5-dimethylhepta-1,3-dien-1-yl]-7,8-dihydroxy-7-methyl-8h-isochromen-6-one
C19H23ClO4 (350.12847880000004)
2-{2-[7-hydroxy-7-(hydroxymethyl)-2-oxabicyclo[2.2.1]heptan-1-yl]ethoxy}-6-(hydroxymethyl)oxane-3,4,5-triol
(3s,4r,7r)-4-ethenyl-3-isothiocyanato-4,8,8-trimethyl-14-azatetracyclo[7.6.1.0²,⁷.0¹³,¹⁶]hexadeca-1,9(16),10,12,14-pentaen-15-ol
(3s,5e,7s,8s,9s,11e)-7,8,9,14,16-pentahydroxy-3-methyl-3,4,7,8,9,10-hexahydro-2-benzoxacyclotetradecin-1-one
(3r,4r)-3-(4-hydroxy-3-methoxyphenyl)-2-oxa-6,11-diazatetracyclo[7.5.2.0⁴,¹⁵.0¹²,¹⁶]hexadeca-1(14),5,9,12,15-pentaen-5-ol
(1r,10s,12r,13e,15s,16s,17s,18r)-18-(acetyloxy)-13-ethylidene-8,15-diazahexacyclo[14.2.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵.0¹²,¹⁷]nonadeca-2,4,6,8-tetraen-15-ium-15-olate
C21H22N2O3 (350.16303419999997)
methyl (9r,12s,13z,16s,17r)-13-ethylidene-18-oxo-8,15-diazahexacyclo[14.2.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵.0¹²,¹⁷]nonadeca-2,4,6-triene-17-carboxylate
C21H22N2O3 (350.16303419999997)
methyl (1r,10r,12r,13z,18r)-13-ethylidene-18-formyl-8,15-diazapentacyclo[10.5.1.0¹,⁹.0²,⁷.0¹⁰,¹⁵]octadeca-2,4,6,8-tetraene-18-carboxylate
C21H22N2O3 (350.16303419999997)
(12r,14s,15r,16s)-11,16-dimethyl-20-oxo-17-oxa-1,11-diazapentacyclo[10.8.1.0²,⁷.0⁸,²¹.0¹⁴,¹⁹]henicosa-2,4,6,8(21),18-pentaene-15-carbaldehyde
C21H22N2O3 (350.16303419999997)
2-{2-[5-hydroxy-2,3-bis(hydroxymethyl)cyclopent-2-en-1-yl]ethoxy}-6-(hydroxymethyl)oxane-3,4,5-triol
methyl (1r,9r,16r,21r)-17-oxo-2,12-diazahexacyclo[14.2.2.1⁹,¹².0¹,⁹.0³,⁸.0¹⁶,²¹]henicosa-3,5,7,14-tetraene-2-carboxylate
C21H22N2O3 (350.16303419999997)
(1s,2r,3s,5r,9r,10r,11r)-2-hydroxy-3-methyl-10-propyl-7,13-dioxatetracyclo[7.5.2.0¹,¹¹.0⁵,⁹]hexadecane-6,8,12,14-tetrone
methyl 18-hydroxy-3,13-diazapentacyclo[11.8.0.0²,¹⁰.0⁴,⁹.0¹⁵,²⁰]henicosa-1,3,5,7,9,11-hexaene-19-carboxylate
C21H22N2O3 (350.16303419999997)
methyl (1s,10r,12s,19s)-12-ethenyl-9-hydroxy-8,16-diazapentacyclo[10.6.1.0¹,¹⁰.0²,⁷.0¹⁶,¹⁹]nonadeca-2,4,6,8,13-pentaene-10-carboxylate
C21H22N2O3 (350.16303419999997)
2-(hydroxymethyl)-6-({5,6,7-trihydroxy-1h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyran-1-yl}oxy)oxane-3,4,5-triol
(1s,2r,11s,13e,15s,16r)-2,5,7,15-tetrahydroxy-11-methyl-10,19-dioxatricyclo[14.2.1.0³,⁸]nonadeca-3,5,7,13-tetraen-9-one
9-hydroxy-3,4a,5-trimethyl-4h,5h,6h,7h,8h,8ah,9h-naphtho[2,3-b]furan-7-yl 3-(methylsulfanyl)prop-2-enoate
7,9,16-trihydroxy-13-methyl-12,19-dioxatricyclo[13.3.1.0⁵,¹⁰]nonadeca-5,7,9-triene-3,11-dione
7-{[(2e,6r)-7-chloro-6-hydroxy-3,7-dimethyloct-2-en-1-yl]oxy}chromen-2-one
C19H23ClO4 (350.12847880000004)
(4s,9s,19s)-19-ethyl-19-hydroxy-17-oxa-3,13-diazapentacyclo[11.8.0.0²,¹¹.0⁴,⁹.0¹⁵,²⁰]henicosa-1(21),2,5,7,10,15(20)-hexaene-14,18-dione
(1r,2r,8ar)-1,8a-dimethyl-6-oxo-7-(propan-2-ylidene)-2,3,4,8-tetrahydro-1h-naphthalen-2-yl (2e)-3-methanesulfinylprop-2-enoate
6-(4-hydroxy-1,6-dimethoxy-7-methyl-3-oxo-1h-2-benzofuran-5-yl)-4-methylhex-4-enoic acid
(2s,4r,6s)-11,12-dimethoxy-8-oxo-4-propyl-3,7-dioxatricyclo[7.4.0.0²,⁶]trideca-1(9),10,12-trien-10-yl acetate
(3e)-3-[(4-hydroxy-3,5-dimethoxyphenyl)methylidene]-1h,2h-pyrrolo[2,1-b]quinazolin-9-one
5-chloro-3-(3,5-dimethylhepta-1,3-dien-1-yl)-7,8-dihydroxy-7-methyl-8h-isochromen-6-one
C19H23ClO4 (350.12847880000004)