Exact Mass: 594.2159748
Exact Mass Matches: 594.2159748
Found 390 metabolites which its exact mass value is equals to given mass value 594.2159748
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Poncirin
(2S)-poncirin is a flavanone glycoside that is 4-methoxy-5,7-dihydroxyflavanone attached to a neohesperidose (alpha-L-rhamnopyranosyl-(1->2)-beta-D-glucopyranose) residue via a glycosidic linkage. It has been isolated from the fruits of Poncirus trifoliata and exhibits inhibitory activity against liopolysaccharide (LPS)-induced prostaglandin E2 and interleukin-6 (IL-6) production. It has a role as a plant metabolite. It is a monomethoxyflavanone, a flavanone glycoside, a disaccharide derivative, a neohesperidoside and a member of 4-methoxyflavanones. It is functionally related to a 4-methoxy-5,7-dihydroxyflavanone. Poncirin is a natural product found in Citrus medica, Micromeria graeca, and other organisms with data available. Isolated from Citrus subspecies Poncirin is found in many foods, some of which are citrus, grapefruit, lemon, and grapefruit/pummelo hybrid. Acquisition and generation of the data is financially supported in part by CREST/JST. Poncirin is found in citrus. Poncirin is isolated from Citrus specie Poncirin is isolated from?Poncirus trifoliata with anti-inflammory activites. Poncirin significantly reduces mechanical hyperalgesia and allodynia in Complete Freund’s Adjuvant (CFA)-induced inflammatory pain models[1]. Poncirin is isolated from?Poncirus trifoliata with anti-inflammory activites. Poncirin significantly reduces mechanical hyperalgesia and allodynia in Complete Freund’s Adjuvant (CFA)-induced inflammatory pain models[1].
Zizybeoside II
Zizybeoside II is found in fruits. Zizybeoside II is a constituent of dried fruits of Chinese jujube (Zizyphus jujuba) Constituent of dried fruits of Chinese jujube (Zizyphus jujuba). Zizybeoside II is found in fruits.
Pyrantel pamoate
D000890 - Anti-Infective Agents > D000977 - Antiparasitic Agents > D000871 - Anthelmintics C254 - Anti-Infective Agent > C276 - Antiparasitic Agent > C250 - Antihelminthic Agent Pyrantel pamoate (Pyrantel embonate) is an orally active anthelmintic and an agonist of the nicotinic acetylcholine receptor (nAChR). Pyrantel pamoate can cause spasmodic muscle paralysis in parasites. Pyrantel pamoate can be used in the study of parasitic infections such as ascariasis, hookworm infections, intestinal worms (pinworm infections), trichinosis and trichinosis[1][2].
Didymin
From leaves of Monarda didyma (bergamot) and Citrus subspecies Didymin is found in many foods, some of which are citrus, tea, sweet orange, and grapefruit. Didymin is found in citrus. Didymin is from leaves of Monarda didyma (bergamot) and Citrus specie Didymin, a dietary flavonoid glycoside from citrus fruits, possesses antioxidant properties. Didymin induces apoptosis by inhibiting N-Myc and upregulating RKIP in neuroblastoma[1][2]. Didymin, a dietary flavonoid glycoside from citrus fruits, possesses antioxidant properties. Didymin induces apoptosis by inhibiting N-Myc and upregulating RKIP in neuroblastoma[1][2].
2-[[(1R)-2-[Bis(carboxymethyl)amino]cyclohexyl]-[(2S)-2-[bis(carboxymethyl)amino]-3-(4-isothiocyanatophenyl)propyl]amino]acetic acid
Didymin
Didymin is a member of flavonoids and a glycoside. Didymin is a natural product found in Citrus latipes, Citrus hystrix, and other organisms with data available. See also: Tangerine peel (part of). Didymin, a dietary flavonoid glycoside from citrus fruits, possesses antioxidant properties. Didymin induces apoptosis by inhibiting N-Myc and upregulating RKIP in neuroblastoma[1][2]. Didymin, a dietary flavonoid glycoside from citrus fruits, possesses antioxidant properties. Didymin induces apoptosis by inhibiting N-Myc and upregulating RKIP in neuroblastoma[1][2].
Pseudolaric acid B-glucopyranoside
Pseudolaric acid B-O-beta-D-glucopyranoside is a natural product found in Pseudolarix amabilis and Larix kaempferi with data available. Pseudolaric acid B β-D-glucoside is a diterpenoid isolated from Pseudolarix kaempferi[1]. Pseudolaric acid B β-D-glucoside is a diterpenoid isolated from Pseudolarix kaempferi[1].
Pseudolaric
Pseudolaric acid B-O-beta-D-glucopyranoside is a natural product found in Pseudolarix amabilis and Larix kaempferi with data available. Pseudolaric acid B β-D-glucoside is a diterpenoid isolated from Pseudolarix kaempferi[1]. Pseudolaric acid B β-D-glucoside is a diterpenoid isolated from Pseudolarix kaempferi[1].
Pseudolaric acid B O-beta-D-glucopyranoside
Pseudolaric acid B β-D-glucoside is a diterpenoid isolated from Pseudolarix kaempferi[1]. Pseudolaric acid B β-D-glucoside is a diterpenoid isolated from Pseudolarix kaempferi[1].
Miconioside B
Acinoside
Poncirin
Poncirin is isolated from?Poncirus trifoliata with anti-inflammory activites. Poncirin significantly reduces mechanical hyperalgesia and allodynia in Complete Freund’s Adjuvant (CFA)-induced inflammatory pain models[1]. Poncirin is isolated from?Poncirus trifoliata with anti-inflammory activites. Poncirin significantly reduces mechanical hyperalgesia and allodynia in Complete Freund’s Adjuvant (CFA)-induced inflammatory pain models[1].
methyl (1S,4aS,7aS)-7-(hydroxymethyl)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(E)-3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoyl]oxymethyl]oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate
2,6-Dihydroxy-4-methoxychalcone-4-O-neohesperid
Annotation level-1
(3beta,16beta,17alpha,18beta,20alpha)-17-hydroxy-11-methoxy-18-[(3,4,5-trimethoxybenzoyl)oxy]-yohimban-16-carboxylic acid, methyl ester|ent-17beta-Hydroxy-11-methoxy-18alpha-(3,4,5-trimethoxy-benzoyloxy)-15beta-yohimban-16alpha-carbonsaeure-methylester|ent-17beta-hydroxy-11-methoxy-18alpha-(3,4,5-trimethoxy-benzoyloxy)-15beta-yohimban-16alpha-carboxylic acid methyl ester|neonorreserpine|reserpine
(1R,2S,3S,4S,5S,6R,7R,9S,10R)-2-acetoxy-1-benzoyloxy-9-trans-cinnamoyloxy-3,4,6-trihydroxydihydro-beta-agarofuran
7-O-[alpha-L-rhamnopyranosyl-(1->6)-beta-D-glucopyranosyl]-5-hydroxy-3-(4-hydroxybenzyl)-chroman-4-one
(1R,2S,3S,4S,5R,7R,9S,10R)-2beta,3beta-diacetoxy-1alpha,9beta-dibenzoyloxy-4beta-hydroxydihydro-(15alpha)-beta-agarofuran
sakuranetin 4-O-(6-O-alpha-L-rhamnopyranosyl)-beta-D-glucopyranoside
ent18alpha-Hydroxy-11-methoxy-17beta-(3,4,5-trimethoxy-benzoyloxy)-15beta-yohimban-16alpha-carbonsaeure-methylester|ent18alpha-hydroxy-11-methoxy-17beta-(3,4,5-trimethoxy-benzoyloxy)-15beta-yohimban-16alpha-carboxylic acid methyl ester
Phenylosazone-betabeta-D-Galactopyranosyl-(1?6)-beta-D-glalctopyranoslyl-(1?4)-D-glucose
6-O-cis-p-coumaroyl-8-O-acetylshanzhiside methyl ester
5a,11-dihydro-1,3,4,7,8,10-hexamethoxy-5a-phenyl-11-styryl-[1]benzopyrano[2,3-b][1]benzopyran|welwitschin H
1alpha,2beta-diacetoxy-6beta,9beta-dibenzoyloxy-4beta-hydroxy-dihydro-beta-agarofuran|salaterpene C
9-O-n-Butyl lithospermate (Dracocephalum forrestii)|9-O-n-butyl-lithospermic acid
(1alpha,2alpha,8beta,9beta)-1,8-bis(acetyloxy)-2,9-bis(benzoyloxy)-14-hydroxy-beta-dihydroagarofuran
afzelechin-(4beta-2)-N-(p-coumaroyl)-6-hydroxytryptamine|lotthanongine
(1R,4S,5S,6R,7R,8S,9R,10S)-1,8-diacetoxy-6,9-dibenzoyloxy-4-hydroxydihydro-beta-agarofuran|(1S,4S,5S,6R,7R,8S,9R,10S)-1,8-diacetoxy-9,6-dibenzoyloxy-4-hydroxy-dihydro-beta-agarofuran
8-O-acetyl-2-O-(beta-glucopyranosyl)mussaenoside|lupulinoside
7-Methylporiol-4-beta-D-xylopyranosyl-D-glucopyranosid
beta-(3,4-dihydroxyphenyl)ethyl-O-alpha-rhamnopyranosyl-(1->4)-2-O-(E)-caffeoyl-alpha-arabinopyranoside
1alpha,9beta-Dibenzoyloxy-6beta,8beta-diacetoxy-4beta-hydroxydihydro-beta-agarofuran
4,2-Dihydroxy-4,6-dimethoxychalcone 4-apiosyl-(1->2)-glucoside
(2alpha,3alpha,4beta)-3,21-Disulfate,Cholest-5-ene-2,3,4,21-tetrol
C27H46O10S2 (594.2532256000001)
Tyr Phe His Glu
Raffinose
Raffinose Pentahydrate is an oligosaccharide. D(+)-Raffinose pentahydrate (D-Raffinose pentahydrate) is a trisaccharide composed of galactose, glucose, and fructose that occurs naturally in a variety of vegetables and grains. D(+)-Raffinose pentahydrate is a functional oligosaccharide. D(+)-Raffinose pentahydrate (D-Raffinose pentahydrate) is a trisaccharide composed of galactose, glucose, and fructose that occurs naturally in a variety of vegetables and grains. D(+)-Raffinose pentahydrate is a functional oligosaccharide.
Shancigusin I
Shancigusin I is a natural compound found in Cremastra appendiculata[1].
2, 6-dihydroxy-4-methoxychalcone-4-O-neohesperidoside
Poncirin
(2S)-poncirin is a flavanone glycoside that is 4-methoxy-5,7-dihydroxyflavanone attached to a neohesperidose (alpha-L-rhamnopyranosyl-(1->2)-beta-D-glucopyranose) residue via a glycosidic linkage. It has been isolated from the fruits of Poncirus trifoliata and exhibits inhibitory activity against liopolysaccharide (LPS)-induced prostaglandin E2 and interleukin-6 (IL-6) production. It has a role as a plant metabolite. It is a monomethoxyflavanone, a flavanone glycoside, a disaccharide derivative, a neohesperidoside and a member of 4-methoxyflavanones. It is functionally related to a 4-methoxy-5,7-dihydroxyflavanone. Poncirin is a natural product found in Citrus medica, Micromeria graeca, and other organisms with data available. A flavanone glycoside that is 4-methoxy-5,7-dihydroxyflavanone attached to a neohesperidose (alpha-L-rhamnopyranosyl-(1->2)-beta-D-glucopyranose) residue via a glycosidic linkage. It has been isolated from the fruits of Poncirus trifoliata and exhibits inhibitory activity against liopolysaccharide (LPS)-induced prostaglandin E2 and interleukin-6 (IL-6) production. Poncirin is isolated from?Poncirus trifoliata with anti-inflammory activites. Poncirin significantly reduces mechanical hyperalgesia and allodynia in Complete Freund’s Adjuvant (CFA)-induced inflammatory pain models[1]. Poncirin is isolated from?Poncirus trifoliata with anti-inflammory activites. Poncirin significantly reduces mechanical hyperalgesia and allodynia in Complete Freund’s Adjuvant (CFA)-induced inflammatory pain models[1].
5-hydroxy-2-(4-methoxyphenyl)-7-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxymethyl]oxan-2-yl]oxy-2,3-dihydrochromen-4-one
C28H34O14_Methyl (1S,4aS,7aS)-1-({6-O-[(2E)-3-(4-hydroxy-3,5-dimethoxyphenyl)-2-propenoyl]-beta-D-glucopyranosyl}oxy)-7-(hydroxymethyl)-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate
Cys Phe Tyr Tyr
Cys Met Arg Trp
Cys Met Trp Arg
Cys Arg Met Trp
Cys Arg Trp Met
Cys Thr Trp Trp
C29H34N6O6S (594.2260424000001)
Cys Trp Met Arg
Cys Trp Arg Met
Cys Trp Thr Trp
C29H34N6O6S (594.2260424000001)
Cys Trp Trp Thr
C29H34N6O6S (594.2260424000001)
Cys Tyr Phe Tyr
Cys Tyr Tyr Phe
Asp Phe Gln Trp
Asp Phe Trp Gln
Asp Gln Phe Trp
Asp Gln Trp Phe
Asp Trp Phe Gln
Asp Trp Gln Phe
Glu Phe His Tyr
Glu Phe Asn Trp
Glu Phe Trp Asn
Glu Phe Tyr His
Glu His Phe Tyr
Glu His Tyr Phe
Glu Asn Phe Trp
Glu Asn Trp Phe
Glu Trp Phe Asn
Glu Trp Asn Phe
Glu Tyr Phe His
Glu Tyr His Phe
Phe Cys Tyr Tyr
Phe Asp Gln Trp
Phe Asp Trp Gln
Phe Glu His Tyr
Phe Glu Asn Trp
Phe Glu Trp Asn
Phe Glu Tyr His
Phe Gly Trp Trp
Phe His Glu Tyr
Phe His Tyr Glu
Phe Asn Glu Trp
Phe Asn Trp Glu
Phe Gln Asp Trp
Phe Gln Trp Asp
Phe Trp Asp Gln
Phe Trp Glu Asn
Phe Trp Gly Trp
Phe Trp Asn Glu
Phe Trp Gln Asp
Phe Trp Trp Gly
Phe Tyr Cys Tyr
Phe Tyr Glu His
Phe Tyr His Glu
Phe Tyr Tyr Cys
Gly Phe Trp Trp
Gly Trp Phe Trp
Gly Trp Trp Phe
His Glu Phe Tyr
His Glu Tyr Phe
His Phe Glu Tyr
His Phe Tyr Glu
His Tyr Glu Phe
His Tyr Phe Glu
Lys Met Met Trp
C27H42N6O5S2 (594.2657962000001)
Lys Met Trp Met
C27H42N6O5S2 (594.2657962000001)
Lys Trp Met Met
C27H42N6O5S2 (594.2657962000001)
Met Cys Arg Trp
Met Cys Trp Arg
Met Lys Met Trp
C27H42N6O5S2 (594.2657962000001)
Met Lys Trp Met
C27H42N6O5S2 (594.2657962000001)
Met Met Lys Trp
C27H42N6O5S2 (594.2657962000001)
Met Met Gln Trp
C26H38N6O6S2 (594.2294128000001)
Met Met Trp Lys
C27H42N6O5S2 (594.2657962000001)
Met Met Trp Gln
C26H38N6O6S2 (594.2294128000001)
Met Gln Met Trp
C26H38N6O6S2 (594.2294128000001)
Met Gln Trp Met
C26H38N6O6S2 (594.2294128000001)
Met Arg Cys Trp
Met Arg Trp Cys
Met Trp Cys Arg
Met Trp Lys Met
C27H42N6O5S2 (594.2657962000001)
Met Trp Met Lys
C27H42N6O5S2 (594.2657962000001)
Met Trp Met Gln
C26H38N6O6S2 (594.2294128000001)
Met Trp Gln Met
C26H38N6O6S2 (594.2294128000001)
Met Trp Arg Cys
Asn Glu Phe Trp
Asn Glu Trp Phe
Asn Phe Glu Trp
Asn Phe Trp Glu
Asn Trp Glu Phe
Asn Trp Phe Glu
Gln Asp Phe Trp
Gln Asp Trp Phe
Gln Phe Asp Trp
Gln Phe Trp Asp
Gln Met Met Trp
C26H38N6O6S2 (594.2294128000001)
Gln Met Trp Met
C26H38N6O6S2 (594.2294128000001)
Gln Trp Asp Phe
Gln Trp Phe Asp
Gln Trp Met Met
C26H38N6O6S2 (594.2294128000001)
Arg Cys Met Trp
Arg Cys Trp Met
Arg Met Cys Trp
Arg Met Trp Cys
Arg Trp Cys Met
Arg Trp Met Cys
Ser Tyr Tyr Tyr
Thr Cys Trp Trp
C29H34N6O6S (594.2260424000001)
Thr Trp Cys Trp
C29H34N6O6S (594.2260424000001)
Thr Trp Trp Cys
C29H34N6O6S (594.2260424000001)
Trp Cys Met Arg
Trp Cys Arg Met
Trp Cys Thr Trp
C29H34N6O6S (594.2260424000001)
Trp Cys Trp Thr
C29H34N6O6S (594.2260424000001)
Trp Asp Phe Gln
Trp Asp Gln Phe
Trp Glu Phe Asn
Trp Glu Asn Phe
Trp Phe Asp Gln
Trp Phe Glu Asn
Trp Phe Gly Trp
Trp Phe Asn Glu
Trp Phe Gln Asp
Trp Phe Trp Gly
Trp Gly Phe Trp
Trp Gly Trp Phe
Trp Lys Met Met
C27H42N6O5S2 (594.2657962000001)
Trp Met Cys Arg
Trp Met Lys Met
C27H42N6O5S2 (594.2657962000001)
Trp Met Met Lys
C27H42N6O5S2 (594.2657962000001)
Trp Met Met Gln
C26H38N6O6S2 (594.2294128000001)
Trp Met Gln Met
C26H38N6O6S2 (594.2294128000001)
Trp Met Arg Cys
Trp Asn Glu Phe
Trp Asn Phe Glu
Trp Gln Asp Phe
Trp Gln Phe Asp
Trp Gln Met Met
C26H38N6O6S2 (594.2294128000001)
Trp Arg Cys Met
Trp Arg Met Cys
Trp Thr Cys Trp
C29H34N6O6S (594.2260424000001)
Trp Thr Trp Cys
C29H34N6O6S (594.2260424000001)
Trp Trp Cys Thr
C29H34N6O6S (594.2260424000001)
Trp Trp Phe Gly
Trp Trp Gly Phe
Trp Trp Thr Cys
C29H34N6O6S (594.2260424000001)
Tyr Cys Phe Tyr
Tyr Cys Tyr Phe
Tyr Glu Phe His
Tyr Glu His Phe
Tyr Phe Cys Tyr
Tyr Phe Glu His
Tyr Phe Tyr Cys
Tyr His Glu Phe
Tyr His Phe Glu
Tyr Ser Tyr Tyr
Tyr Tyr Cys Phe
Tyr Tyr Phe Cys
Tyr Tyr Ser Tyr
Tyr Tyr Tyr Ser
(s,s)-1-(dicyclohexylphosphino)-2-[1-(diphenylphosphino)ethyl]ferrocene
1-(3,5-BIS(TRIFLUOROMETHYL)PHENYL)-3-((1R)-(6-METHOXYQUINOLIN-4-YL)((2R,4S,5R)-5-VINYLQUINUCLIDIN-2-YL)METHYL)THIOUREA
(R)-(-)-1-[(S)-2-(Dicyclohexylphosphino)ferrocenyl]ethyldiphenylphosphine
Benzenesulfonic acid,2,5-dichloro-4-[4-[2-(4-dodecylphenyl)diazenyl]-4,5-dihydro-3-methyl-5-oxo-1H-pyrazol-1-yl]-,sodium salt (1:1)
Epi-N-Quinyl-N’-bis(3,5-trifluoromethyl)phenylthiourea
Glycine, N-((1R,2R)-2-(bis(carboxymethyl)amino)cyclohexyl)-N-((2R)-2-(bis(carboxymethyl)amino)-3-(4-isothiocyanatophenyl)propyl)-, rel-
alpha-D-Gal-(1->3)-beta-D-Gal-(1->4)-beta-D-GlcOBn
beta-(4-hydroxyphenyl)ethyl-4-O-E-caffeoyl-O-[beta-D-apiofuranosyl-(1->2)]-beta-D-glucopyranoside
A phenylethanoid that is the 4-O-E-caffeoyl-O-[beta-D-apiofuranosyl-(1->2)]-beta-D-glucopyranosyl derivative of 4-(2-hydroxyethyl)phenol. Isolated from Lepisorus contortus, it exhibits inhibitory activities against aromatase and NF-kappaB.
beta-(4-hydroxyphenyl)ethyl-3-O-E-caffeoyl-O-[beta-D-apiofuranosyl-(1->2)]-beta-D-glucopyranoside
A natural product found in Lepisorus contortus.
N-[[(4R,5R)-8-[2-(2-fluorophenyl)ethynyl]-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methyl-1,3-benzodioxole-5-carboxamide
N-[(2S,4aS,12aS)-5-methyl-6-oxo-2-[2-oxo-2-[(4-phenylphenyl)methylamino]ethyl]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-5-methyl-3-isoxazolecarboxamide
N-[[(4R,5S)-8-[2-(2-fluorophenyl)ethynyl]-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methyl-1,3-benzodioxole-5-carboxamide
N-[[(4R,5S)-8-[2-(2-fluorophenyl)ethynyl]-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methyl-1,3-benzodioxole-5-carboxamide
N-[[(4S,5R)-8-[2-(2-fluorophenyl)ethynyl]-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methyl-1,3-benzodioxole-5-carboxamide
N-[[(4S,5S)-8-[2-(2-fluorophenyl)ethynyl]-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methyl-1,3-benzodioxole-5-carboxamide
N-[[(4R,5R)-8-[2-(2-fluorophenyl)ethynyl]-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methyl-1,3-benzodioxole-5-carboxamide
N-[[(10S,11R)-13-[(2S)-1-hydroxypropan-2-yl]-11,16-dimethyl-14-oxo-9-oxa-13,16-diazatetracyclo[13.7.0.02,7.017,22]docosa-1(15),2,4,6,17,19,21-heptaen-10-yl]methyl]-N,3,5-trimethyl-1,2-oxazole-4-sulfonamide
N-[(2R,4aS,12aR)-5-methyl-6-oxo-2-[2-oxo-2-[(4-phenylphenyl)methylamino]ethyl]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-5-methyl-3-isoxazolecarboxamide
N-[(2R,4aR,12aR)-5-methyl-6-oxo-2-[2-oxo-2-[(4-phenylphenyl)methylamino]ethyl]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-5-methyl-3-isoxazolecarboxamide
N-[[(4S,5S)-8-[2-(2-fluorophenyl)ethynyl]-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methyl-1,3-benzodioxole-5-carboxamide
N-[[(4S,5R)-8-[2-(2-fluorophenyl)ethynyl]-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-N-methyl-1,3-benzodioxole-5-carboxamide
N-[(2S,4aR,12aR)-5-methyl-6-oxo-2-[2-oxo-2-[(4-phenylphenyl)methylamino]ethyl]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-5-methyl-1,2-oxazole-3-carboxamide
N-[(2S,4aS,12aR)-5-methyl-6-oxo-2-[2-oxo-2-[(4-phenylphenyl)methylamino]ethyl]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-5-methyl-3-isoxazolecarboxamide
N-[(2R,4aR,12aS)-5-methyl-6-oxo-2-[2-oxo-2-[(4-phenylphenyl)methylamino]ethyl]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-5-methyl-3-isoxazolecarboxamide
N-[(2S,4aR,12aS)-5-methyl-6-oxo-2-[2-oxo-2-[(4-phenylphenyl)methylamino]ethyl]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-5-methyl-3-isoxazolecarboxamide
N-[[(10R,11S)-13-[(2S)-1-hydroxypropan-2-yl]-11,16-dimethyl-14-oxo-9-oxa-13,16-diazatetracyclo[13.7.0.02,7.017,22]docosa-1(15),2,4,6,17,19,21-heptaen-10-yl]methyl]-N,3,5-trimethyl-1,2-oxazole-4-sulfonamide
N-[[(10S,11S)-13-[(2S)-1-hydroxypropan-2-yl]-11,16-dimethyl-14-oxo-9-oxa-13,16-diazatetracyclo[13.7.0.02,7.017,22]docosa-1(15),2,4,6,17,19,21-heptaen-10-yl]methyl]-N,3,5-trimethyl-1,2-oxazole-4-sulfonamide
1-[[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-9-[(4-methylphenyl)sulfonylamino]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl]-1-methyl-3-phenylurea
1-[[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-9-[(4-methylphenyl)sulfonylamino]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl]-1-methyl-3-phenylurea
N-[(2S,3R)-2-[[[(1,3-benzodioxol-5-ylamino)-oxomethyl]-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-4,4,4-trifluorobutanamide
1-[[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-9-[(4-methylphenyl)sulfonylamino]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl]-1-methyl-3-phenylurea
N-[[(10S,11R)-13-[(2R)-1-hydroxypropan-2-yl]-11,16-dimethyl-14-oxo-9-oxa-13,16-diazatetracyclo[13.7.0.02,7.017,22]docosa-1(15),2,4,6,17,19,21-heptaen-10-yl]methyl]-N,3,5-trimethyl-1,2-oxazole-4-sulfonamide
N-[[(10R,11R)-13-[(2S)-1-hydroxypropan-2-yl]-11,16-dimethyl-14-oxo-9-oxa-13,16-diazatetracyclo[13.7.0.02,7.017,22]docosa-1(15),2,4,6,17,19,21-heptaen-10-yl]methyl]-N,3,5-trimethyl-1,2-oxazole-4-sulfonamide
N-[(2R,4aS,12aS)-5-methyl-6-oxo-2-[2-oxo-2-[(4-phenylphenyl)methylamino]ethyl]-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-8-yl]-5-methyl-3-isoxazolecarboxamide
2-[(2S,4aS,12aR)-8-[[(3,4-difluoroanilino)-oxomethyl]amino]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]-N-[(2-methoxyphenyl)methyl]acetamide
2-[(2S,4aR,12aS)-8-[[(3,4-difluoroanilino)-oxomethyl]amino]-5-methyl-6-oxo-2,3,4,4a,12,12a-hexahydropyrano[2,3-c][1,5]benzoxazocin-2-yl]-N-[(2-methoxyphenyl)methyl]acetamide
N-[(2S,3R)-2-[[[(1,3-benzodioxol-5-ylamino)-oxomethyl]-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-4,4,4-trifluorobutanamide
N-[(2R,3S)-2-[[[(1,3-benzodioxol-5-ylamino)-oxomethyl]-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-4,4,4-trifluorobutanamide
1-[[(2S,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-9-[(4-methylphenyl)sulfonylamino]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl]-1-methyl-3-phenylurea
1-[[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-9-[(4-methylphenyl)sulfonylamino]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl]-1-methyl-3-phenylurea
1-[(4R,7R,8S)-5-[(2-chlorophenyl)methyl]-8-methoxy-4,7,10-trimethyl-11-oxo-2-oxa-5,10-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-(2-methoxyphenyl)urea
N-[(5S,6R,9R)-5-methoxy-3,6,9-trimethyl-2-oxo-8-[1-oxo-2-(3-pyridinyl)ethyl]-11-oxa-3,8-diazabicyclo[10.4.0]hexadeca-1(12),13,15-trien-14-yl]-3-methylbenzenesulfonamide
N-[[(10R,11R)-13-[(2R)-1-hydroxypropan-2-yl]-11,16-dimethyl-14-oxo-9-oxa-13,16-diazatetracyclo[13.7.0.02,7.017,22]docosa-1(15),2,4,6,17,19,21-heptaen-10-yl]methyl]-N,3,5-trimethyl-1,2-oxazole-4-sulfonamide
N-[[(10R,11S)-13-[(2R)-1-hydroxypropan-2-yl]-11,16-dimethyl-14-oxo-9-oxa-13,16-diazatetracyclo[13.7.0.02,7.017,22]docosa-1(15),2,4,6,17,19,21-heptaen-10-yl]methyl]-N,3,5-trimethyl-1,2-oxazole-4-sulfonamide
N-[[(10S,11S)-13-[(2R)-1-hydroxypropan-2-yl]-11,16-dimethyl-14-oxo-9-oxa-13,16-diazatetracyclo[13.7.0.02,7.017,22]docosa-1(15),2,4,6,17,19,21-heptaen-10-yl]methyl]-N,3,5-trimethyl-1,2-oxazole-4-sulfonamide
L-alpha-D-Hepp-(1->7)-L-alpha-D-Hepp-(1->3)-L-alpha-D-Hepp
(1S)-1alpha-[6-O-[(E)-3,5-Dimethoxy-4-hydroxycinnamoyl]-beta-D-glucopyranosyloxy]-7-(hydroxymethyl)-1,4aalpha,5,7aalpha-tetrahydrocyclopenta[c]pyran-4-carboxylic acid methyl ester
(E)-1-[4-[(2S,4R,5S)-4,5-dihydroxy-6-(hydroxymethyl)-3-[(2S,4S,5R)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]oxy-2,6-dihydroxyphenyl]-3-(4-methoxyphenyl)prop-2-en-1-one
LXRβ agonist-4
LXRβ agonist-4 is a potent, orally active Liver X receptors (LXRs) agonist with an IC50 value of 0.0078 μM for LXRβ. LXRβ agonist-4 inhibits RANKL-induced osteoclast differentiation and bone resorption. LXRβ agonist-4 can be used in research of osteoporosis[1].
methyl (1s,2s,3r,4r,7s,8e,10r,12s,13r,14s)-2,10,12,14-tetrakis(acetyloxy)-3-hydroxy-4,13-dimethyl-17-methylidene-5-oxo-6-oxatricyclo[11.4.0.0³,⁷]heptadec-8-ene-9-carboxylate
7-{[4,5-dihydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]oxy}-5-hydroxy-2-(4-methoxyphenyl)-2,3-dihydro-1-benzopyran-4-one
(2e)-3-(4-{[(2r,3r,4s,5s,6r)-3-{[(2s,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)-1-(2-hydroxy-4,6-dimethoxyphenyl)prop-2-en-1-one
8-(acetyloxy)-9-hydroxy-3,4,5,19-tetramethoxy-9,10-dimethyl-15,17-dioxatetracyclo[10.7.0.0²,⁷.0¹⁴,¹⁸]nonadeca-1(12),2(7),3,5,13,18-hexaen-11-yl benzoate
3-{[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-5-hydroxy-6-(hydroxymethyl)-2-[2-(4-hydroxyphenyl)ethoxy]oxan-4-yl 3-(3,4-dihydroxyphenyl)prop-2-enoate
(2r,3s,4s,5r,6r)-5-{[(2s,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-4-hydroxy-2-(hydroxymethyl)-6-[2-(4-hydroxyphenyl)ethoxy]oxan-3-yl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate
(1s,10r)-10-[(2r)-butan-2-yl]-13-[(2s)-butan-2-yl]-6-[2,5-dihydroxy-4-(4-hydroxyphenyl)-3,6-dioxocyclohexa-1,4-dien-1-yl]-12,14-dihydroxy-11-oxo-2,9-dioxa-1,12-diazatricyclo[8.4.0.0³,⁸]tetradeca-3,5,7,13-tetraen-1-ium-1-olate
methyl (1s,4as,5r,7s,7as)-7-(acetyloxy)-5-{[(2z)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}-7-methyl-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-4-carboxylate
3-{4-[(3-{[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy]phenyl}-1-(2-hydroxy-4,6-dimethoxyphenyl)prop-2-en-1-one
(2s,3r,4r,5r,6s)-2-{[(2r,3r,4s,5r,6r)-3-{[(2s,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-2-[2-(3,4-dihydroxyphenyl)ethoxy]-5-hydroxy-6-(hydroxymethyl)oxan-4-yl]oxy}-6-methyloxane-3,4,5-triol
n-[(2s,3r,4s,5s,6r)-2-{[(2r,3s,4s,5r,6r)-6-{[(3ar,4r,5r,6s,6as)-4-hydroxy-6-(hydroxymethyl)-2-imino-hexahydrocyclopenta[d][1,3]oxazol-5-yl]oxy}-4-hydroxy-5-[(1-hydroxyethylidene)amino]-2-(hydroxymethyl)oxan-3-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-3-yl]ethanimidic acid
6'-o-acetylpseudolaricacid b-o-β-d-glucopyra-noside
{"Ingredient_id": "HBIN012608","Ingredient_name": "6'-o-acetylpseudolaricacid b-o-\u03b2-d-glucopyra-noside","Alias": "NA","Ingredient_formula": "C29H38O13","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "489","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
Bird pyrimidine
{"Ingredient_id": "HBIN018546","Ingredient_name": "Bird pyrimidine","Alias": "NA","Ingredient_formula": "C34H30N2O6S","Ingredient_Smile": "CN1CCCN=C1C=CC2=CC=CS2.C1=CC=C2C(=C1)C=C(C(=C2CC3=C(C(=CC4=CC=CC=C43)C(=O)O)O)O)C(=O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "37941","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}