Exact Mass: 310.1086
Exact Mass Matches: 310.1086
Found 235 metabolites which its exact mass value is equals to given mass value 310.1086,
within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error
0.001 dalton.
Picrotin
Picrotin is an organic heteropentacyclic compound that is picrotoxinin in which the olefinic double bond has undergone addition of water to give the corresponding tertiary alcohol. It is the less toxic component of picrotoxin, lacking GABA activity. It has a role as a plant metabolite. It is an organic heteropentacyclic compound, an epoxide, a tertiary alcohol, a gamma-lactone, a diol and a picrotoxane sesquiterpenoid. It is functionally related to a picrotoxinin. Picrotin is a natural product found in Dendrobium moniliforme and Anamirta cocculus with data available. Picrotin belongs to the class of organic compounds known as furopyrans. These are organic polycyclic compounds containing a furan ring fused to a pyran ring. Furan is a five-membered aromatic ring with four carbon atoms and one oxygen atom. Pyran a six-membered heterocyclic, non-aromatic ring, made up of five carbon atoms and one oxygen atom and containing two double bonds. Picrotin is soluble (in water) and a very weakly acidic compound (based on its pKa). C78272 - Agent Affecting Nervous System > C47795 - CNS Stimulant Picrotin is an active compound, also is one of the composition of picrotoxin (an antagonist of GABAA receptors (GABAARs) and glycine receptors (GlyRs)). Picrotin has sensitivity for GlyRs/b> with IC50 values range from 5.2 μM to 106 μM. Picrotin can be used for the research of neurotransmission[1][2]. Picrotin is an active compound, also is one of the composition of picrotoxin (an antagonist of GABAA receptors (GABAARs) and glycine receptors (GlyRs)). Picrotin has sensitivity for GlyRs/b> with IC50 values range from 5.2 μM to 106 μM. Picrotin can be used for the research of neurotransmission[1][2]. Picrotin is an active compound, also is one of the composition of picrotoxin (an antagonist of GABAA receptors (GABAARs) and glycine receptors (GlyRs)). Picrotin has sensitivity for GlyRs/b> with IC50 values range from 5.2 μM to 106 μM. Picrotin can be used for the research of neurotransmission[1][2].
trans-cinnamoyl-beta-D-glucoside
Trans-cinnamoyl-beta-d-glucoside, also known as 1-O-trans-cinnamoyl-beta-D-glucopyranose, is a member of the class of compounds known as O-cinnamoyl glycosides. O-cinnamoyl glycosides are o-glycoside derivatives of cinnamic acid. Cinnamic acid is an aromatic compound containing a benzene and a carboxylic acid group forming 3-phenylprop-2-enoic acid. Trans-cinnamoyl-beta-d-glucoside is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Trans-cinnamoyl-beta-d-glucoside can be found in a number of food items such as angelica, cherry tomato, garden cress, and yam, which makes trans-cinnamoyl-beta-d-glucoside a potential biomarker for the consumption of these food products. Trans-cinnamoyl-β-d-glucoside, also known as 1-O-trans-cinnamoyl-beta-D-glucopyranose, is a member of the class of compounds known as O-cinnamoyl glycosides. O-cinnamoyl glycosides are o-glycoside derivatives of cinnamic acid. Cinnamic acid is an aromatic compound containing a benzene and a carboxylic acid group forming 3-phenylprop-2-enoic acid. Trans-cinnamoyl-β-d-glucoside is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Trans-cinnamoyl-β-d-glucoside can be found in a number of food items such as angelica, cherry tomato, garden cress, and yam, which makes trans-cinnamoyl-β-d-glucoside a potential biomarker for the consumption of these food products.
Glutamyltyrosine
Glutamyltyrosine is a dipeptide composed of glutamate and tyrosine, and is a proteolytic breakdown product of larger proteins. It belongs to the family of N-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid which bears an acyl group at its terminal nitrogen atom. Glutamyltyrosine is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis. Glutamyltyrosine, also known as alpha-glu-tyr or E-Y, is a member of the class of compounds known as dipeptides. Dipeptides are organic compounds containing a sequence of exactly two alpha-amino acids joined by a peptide bond. Glutamyltyrosine is practically insoluble (in water) and a weakly acidic compound (based on its pKa). Glutamyltyrosine can be found in soy bean, which makes glutamyltyrosine a potential biomarker for the consumption of this food product. Glutamyltyrosine can be found primarily in feces.
Gamma-glutamyltyrosine
gamma-Glutamyltyrosine is a dipeptide composed of gamma-glutamate and tyrosine, and is a proteolytic breakdown product of larger proteins. It belongs to the family of N-acyl-alpha amino acids and derivatives. These are compounds containing an alpha amino acid which bears an acyl group at its terminal nitrogen atom. gamma-Glutamyltyrosine is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis. γ-Glu-Tyr, a competitive inhibitor of dipeptidyl peptidase-IV (DPP-IV) (IC50=6.77 mM), is a potentially functional component of the type 2 diabetes diet[1].
(E)-1-O-Cinnamoyl-beta-D-glucose
(E)-1-O-Cinnamoyl-beta-D-glucose is found in fruits. (E)-1-O-Cinnamoyl-beta-D-glucose is a constituent of Vaccinium vitis-idaea (cowberry)
4-(4'-O-Acetyl-alpha-L-rhamnosyloxy)benzaldehyde
4-(4-O-Acetyl-alpha-L-rhamnosyloxy)benzaldehyde has been isolated from the leaves of Moringa oleifera (horseradish tree). It is found in fats and oils as well as in herbs and spices. Isolated from Moringa oleifera (horseradish tree). 1-Pentadecanecarboxylic acid is found in fats and oils and herbs and spices.
(E)-2-O-Cinnamoyl-beta-D-glucopyranose
(E)-2-O-Cinnamoyl-beta-D-glucopyranose is found in green vegetables. (E)-2-O-Cinnamoyl-beta-D-glucopyranose is a constituent of commercial rhubarb, Rheum sp Constituent of commercial rhubarb, Rheum species (E)-2-O-Cinnamoyl-beta-D-glucopyranose is found in green vegetables.
Tyrosyl-Glutamate
Tyrosyl-Glutamate is a dipeptide composed of tyrosine and glutamate. It is an incomplete breakdown product of protein digestion or protein catabolism. Some dipeptides are known to have physiological or cell-signaling effects although most are simply short-lived intermediates on their way to specific amino acid degradation pathways following further proteolysis. This dipeptide has not yet been identified in human tissues or biofluids and so it is classified as an Expected metabolite.
Mabuterol
D019141 - Respiratory System Agents > D018927 - Anti-Asthmatic Agents > D001993 - Bronchodilator Agents C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C87053 - Adrenergic Agonist D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D000322 - Adrenergic Agonists D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents
Valine-betaxanthin
7-(2,3-Dihydroxy-3-methylbutyloxy)-5-hydroxy-6-methoxycoumarin
Mabuterol
D019141 - Respiratory System Agents > D018927 - Anti-Asthmatic Agents > D001993 - Bronchodilator Agents C78272 - Agent Affecting Nervous System > C29747 - Adrenergic Agent > C87053 - Adrenergic Agonist D018377 - Neurotransmitter Agents > D018663 - Adrenergic Agents > D000322 - Adrenergic Agonists D018373 - Peripheral Nervous System Agents > D001337 - Autonomic Agents CONFIDENCE standard compound; INTERNAL_ID 1102
(3R*,4S*,5E,8S*,10S*)-3,8-epoxy-3,4,13-trihydroxy-1-oxogermacra-5,7(11)-dien-6,12-olide|potamopholide
2,9-Dihydroxy-dibenz[a,h]anthracen|Dibenz[a,h]anthracen-2,9-diol|dibenz[a,h]anthracene-2,9-diol
2beta,3beta-dihydroxy-11beta,13-dihydrodeoxymikanolide
methyl (2R,3R,4R,4aS,7aR)-3-hydroxy-4-[(S)-1-hydroxyethyl]-5-oxo-3,4,4a,7a-tetrahydro-1H,5H-spiro[cyclopenta[c]pyran-7,2-furan]-4-carboxylate|plumeridoid C
1-{2-[(1E)-1-(5-chloro-1H-pyrrol-2-yl)prop-1-en-2-yl]-1,3-oxazol-4-yl}-2-methylbutane-1,3-diol|Pyrronazol C1
Picrotin
relative retention time with respect to 9-anthracene Carboxylic Acid is 0.508 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.502 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.503 Picrotin is an active compound, also is one of the composition of picrotoxin (an antagonist of GABAA receptors (GABAARs) and glycine receptors (GlyRs)). Picrotin has sensitivity for GlyRs/b> with IC50 values range from 5.2 μM to 106 μM. Picrotin can be used for the research of neurotransmission[1][2]. Picrotin is an active compound, also is one of the composition of picrotoxin (an antagonist of GABAA receptors (GABAARs) and glycine receptors (GlyRs)). Picrotin has sensitivity for GlyRs/b> with IC50 values range from 5.2 μM to 106 μM. Picrotin can be used for the research of neurotransmission[1][2]. Picrotin is an active compound, also is one of the composition of picrotoxin (an antagonist of GABAA receptors (GABAARs) and glycine receptors (GlyRs)). Picrotin has sensitivity for GlyRs/b> with IC50 values range from 5.2 μM to 106 μM. Picrotin can be used for the research of neurotransmission[1][2].
6-O-cinnamoyl-D-glucopyranose|6-O-cinnamoyl-D-glucopyranose|6-O-cinnamoylglucose
5-Hydroxy-6-methoxy-7-(2,3-dihydroxy-3-methylbutoxy)coumarin
gamma-Glutamyltyrosine
γ-Glu-Tyr, a competitive inhibitor of dipeptidyl peptidase-IV (DPP-IV) (IC50=6.77 mM), is a potentially functional component of the type 2 diabetes diet[1].
[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (E)-3-phenylprop-2-enoate
gamma-Glu-tyr
A dipeptide composed of L-glutamic acid and L-tyrosine joined by a peptide linkage.
Lymphostin
A member of the class of pyrroloquinolines that is pyrrolo[4,3,2-de]quinoline in which the hydrogens at positions 4, 6 and 8 are replaced by (1E)-1-methoxy-3-oxoprop-1-en-3-yl, acetylamino and amino groups, respectively. It is an alkaloid isolated from Streptomyces and Salinispora species, exhibits potent immunosuppressive activity, and inhibits Fyn and Lck protein kinases.
[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (E)-3-phenylprop-2-enoate [IIN-based on: CCMSLIB00000848381]
[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl] (E)-3-phenylprop-2-enoate [IIN-based: Match]
(E)-1-O-Cinnamoyl-beta-D-glucose
(E)-2-O-Cinnamoyl-beta-D-glucopyranose
ethyl 2-chloro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)benzoate
Pyrimido[1,2-a]benzimidazol-4-amine, N-(3,4-difluorophenyl)-2-methyl- (9CI)
Butanedioic acid,2-(diethoxyphosphinyl)-, 1,4-diethyl ester
3-(4-butylphenyl)-2-sulfanylidene-1H-quinazolin-4-one
1-(2-BENZO[1,3]DIOXOL-5-YL-IMIDAZO[1,2-A]PYRIMIDIN-3-YLMETHYL)-PIPERIDINE-4-CARBOXYLICACID
4-[CARBOXY-(4-METHOXY-PHENYL)-METHYL]-PIPERAZINE-1-CARBOXYLICACIDTERT-BUTYLESTERHYDROCHLORIDE
5-(1-Piperazinyl)-2-benzofurancarboxylic acid ethyl ester hydrochloride
1-(Diphenylmethyl)-3-azetidinamine dihydrochloride
N-{8-amino-4-[(2E)-3-methoxyprop-2-enoyl]pyrrolo[4,3,2-de]quinolin-6-yl}acetamide
6-Methoxy-4-methyl-2-[(2-methylphenyl)methylthio]quinazoline
4-Hydroxy-3-nitrophenylacetyl-epsilon-aminocaproic acid
1,2-Benzenedicarboxylic acid, bis(trimethylsilyl) ester
(5s)-2-{[(1s)-1-(4-Fluorophenyl)ethyl]amino}-5-(1-Hydroxy-1-Methylethyl)-5-Methyl-1,3-Thiazol-4(5h)-One
4-Amino-5-(2-amino-3-phenylpropanoyl)peroxy-5-oxopentanoic acid
Microdiplodiasol
A member of the class of xanthones that is 1,2,3,4,4a,9a-hexahydro-9H-xanthen-9-one substituted by hydroxy groups at positions 1, 4, 8 and 9a, a hydroxymethyl group at position 6 and a methyl group at position 4a. Isolated from the endophytic fungus Microdiplodia species, it exhibits antibacterial activity.
4-[[2-(1-Benzotriazolyl)-1-oxoethyl]amino]benzoic acid methyl ester
3-[[2-(1-Benzotriazolyl)-1-oxoethyl]amino]benzoic acid methyl ester
N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-3-methylbenzamide
2,7-Diamino-3-[(2-fluorophenyl)diazenyl]-5-methylpyrazolo[1,5-a]pyrimidine-6-carbonitrile
3,4-dihydro-1H-isoquinolin-2-yl-(4-ethyl-5-thieno[3,2-b]pyrrolyl)methanone
N-[[1H-benzimidazol-2-yl(oxo)methyl]amino]carbamic acid (phenylmethyl) ester
(2R,3R,4S)-1-(2-fluorobenzoyl)-4-(hydroxymethyl)-3-phenylazetidine-2-carbonitrile
(2S,3R,4R)-1-[(2-fluorophenyl)-oxomethyl]-4-(hydroxymethyl)-3-phenyl-2-azetidinecarbonitrile
(2R,3S,4S)-1-[(2-fluorophenyl)-oxomethyl]-4-(hydroxymethyl)-3-phenyl-2-azetidinecarbonitrile
3-(4-Tert-butylanilino)-2-(thiophene-3-carbonyl)prop-2-enenitrile
(2S,3R,4S)-1-[(2-fluorophenyl)-oxomethyl]-4-(hydroxymethyl)-3-phenyl-2-azetidinecarbonitrile
(2S,3S,4R)-1-[(2-fluorophenyl)-oxomethyl]-4-(hydroxymethyl)-3-phenyl-2-azetidinecarbonitrile
(2S,3S,4S)-1-[(2-fluorophenyl)-oxomethyl]-4-(hydroxymethyl)-3-phenyl-2-azetidinecarbonitrile
(2R,3R,4R)-1-[(2-fluorophenyl)-oxomethyl]-4-(hydroxymethyl)-3-phenyl-2-azetidinecarbonitrile
(2R,3S,4R)-1-[(2-fluorophenyl)-oxomethyl]-4-(hydroxymethyl)-3-phenyl-2-azetidinecarbonitrile
N-Acetyl-4-(3-methoxyacryloyl)pyrrolo[4,3,2-de]quinoline-6,8-diamine
1-Acetyl-3-(4-nitrophenyl)-4-(pyridin-2-yl)-2-pyrazoline
1-Acetyl-4-(4-nitrophenyl)-3-(pyridin-2-yl)-2-pyrazoline
Pikrotin
Picrotin is an organic heteropentacyclic compound that is picrotoxinin in which the olefinic double bond has undergone addition of water to give the corresponding tertiary alcohol. It is the less toxic component of picrotoxin, lacking GABA activity. It has a role as a plant metabolite. It is an organic heteropentacyclic compound, an epoxide, a tertiary alcohol, a gamma-lactone, a diol and a picrotoxane sesquiterpenoid. It is functionally related to a picrotoxinin. Picrotin is a natural product found in Dendrobium moniliforme and Anamirta cocculus with data available. An organic heteropentacyclic compound that is picrotoxinin in which the olefinic double bond has undergone addition of water to give the corresponding tertiary alcohol. It is the less toxic component of picrotoxin, lacking GABA activity. C78272 - Agent Affecting Nervous System > C47795 - CNS Stimulant Picrotin is an active compound, also is one of the composition of picrotoxin (an antagonist of GABAA receptors (GABAARs) and glycine receptors (GlyRs)). Picrotin has sensitivity for GlyRs/b> with IC50 values range from 5.2 μM to 106 μM. Picrotin can be used for the research of neurotransmission[1][2]. Picrotin is an active compound, also is one of the composition of picrotoxin (an antagonist of GABAA receptors (GABAARs) and glycine receptors (GlyRs)). Picrotin has sensitivity for GlyRs/b> with IC50 values range from 5.2 μM to 106 μM. Picrotin can be used for the research of neurotransmission[1][2]. Picrotin is an active compound, also is one of the composition of picrotoxin (an antagonist of GABAA receptors (GABAARs) and glycine receptors (GlyRs)). Picrotin has sensitivity for GlyRs/b> with IC50 values range from 5.2 μM to 106 μM. Picrotin can be used for the research of neurotransmission[1][2].
[3,4,5-Trihydroxy-6-(hydroxymethyl)oxan-2-yl] 3-phenylprop-2-enoate
GK187
GK187 is a potent and selective Group VIA calcium-independent phospholipase A2 (GVIA iPLA2) inhibitor with an XI(50) value of 0.0001. GK187 can be used for researching various neurological disorders[1]. [The XI(50) is the mole fraction of the inhibitor in the total substrate interface required to inhibit the enzyme by 50\%.]
ML254
ML254 is a potent mGlu5 potentiator, with EC50 and pEC50 of 9.3 nM and 8.03 nM for rat mGlu5, respectively. ML254 can be used for researching schizophrenia[1]. ML254 is a click chemistry reagent, it contains an Alkyne group and can undergo copper-catalyzed azide-alkyne cycloaddition (CuAAc) with molecules containing Azide groups.
3-{4-[(3r,4r,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]phenyl}prop-2-enoic acid
6,9-dihydroxy-2,11-dimethyl-4,8,14-trioxapentacyclo[7.4.2.1⁷,¹⁰.0¹,¹⁰.0²,⁶]hexadecane-5,15-dione
(1r,2r,3s,7r,8s,11r,13r,14s)-2,7-dihydroxy-3,14-dimethyl-5,9,12-trioxapentacyclo[6.6.1.1²,¹³.0¹,¹¹.0³,⁷]hexadecane-6,10-dione
(2s,4e)-4-[(2e)-2-[(4-carboxybutyl)imino]ethylidene]-2,3-dihydro-1h-pyridine-2,6-dicarboxylic acid
1-hydroxy-14-(2-hydroxypropan-2-yl)-13-methyl-4,7,10-trioxapentacyclo[6.4.1.1⁹,¹².0³,⁵.0⁵,¹³]tetradecane-6,11-dione
7-[(2r)-2,3-dihydroxy-3-methylbutoxy]-5-hydroxy-6-methoxychromen-2-one
7-hydroxy-8-methoxy-3-[(1s,2r)-1,2,3-trihydroxy-3-methylbutyl]chromen-2-one
n-{11-amino-6-[(2e)-3-methoxyprop-2-enoyl]-2,7-diazatricyclo[6.3.1.0⁴,¹²]dodeca-1,3,5,8(12),10-pentaen-9-ylidene}acetamide
2,7-dihydroxy-3,14-dimethyl-5,9,12-trioxapentacyclo[6.6.1.1²,¹³.0¹,¹¹.0³,⁷]hexadecane-6,10-dione
(1r,2s,5r,6s,10r,11s,14r)-5,10,14-trihydroxy-2,6-dimethyl-8,12-dioxatetracyclo[9.3.1.0¹,⁵.0⁶,¹⁰]pentadec-3-ene-9,13-dione
4,5,8-trihydroxy-2-(hydroxymethyl)-6-methoxy-3-(2-oxopropyl)-3,4-dihydro-2h-naphthalen-1-one
(3r,4as,5r,10as)-3,5,6,9-tetrahydroxy-7-methoxy-3-methyl-1h,4h,4ah,5h,10ah-naphtho[2,3-c]pyran-10-one
n-[(2s,3r)-1-ethoxy-3-hydroxy-1-oxobutan-2-yl]-2-hydroxy-3-[(hydroxymethylidene)amino]benzenecarboximidic acid
7,9-dihydroxy-4-(2-hydroxypropyl)-8-methoxy-4,5-dihydro-1h-3-benzoxocine-2,6-dione
methyl (2e)-3-(2-{[(2r,3r,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}phenyl)prop-2-enoate
1,5,8,8a-tetrahydroxy-3-(hydroxymethyl)-10a-methyl-5,6,7,8-tetrahydroxanthen-9-one
1,2-dehydroneomajucin
{"Ingredient_id": "HBIN000778","Ingredient_name": "1,2-dehydroneomajucin","Alias": "NA","Ingredient_formula": "C15H18O7","Ingredient_Smile": "CC1=CCC2(C13CC(C4(C2(COC4=O)C)O)OC(=O)C3O)O","Ingredient_weight": "310.3 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "4951","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "11141421","DrugBank_id": "NA"}
1-(4-Coumaroyl)alpha-rhamnopyranose
{"Ingredient_id": "HBIN001396","Ingredient_name": "1-(4-Coumaroyl)alpha-rhamnopyranose","Alias": "(E)-3-(4-hydroxyphenyl)prop-2-enoic acid [(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-2-tetrahydropyranyl] ester; 1-Carp; [(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-oxan-2-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate; alpha-L-Mannopyranose, 6-deoxy-, 1-(3-(4-hydroxyphenyl)-2-propenoate), (E)-; [(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate; 102719-86-8; [(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate; (E)-3-(4-hydroxyphenyl)acrylic acid [(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyl-tetrahydropyran-2-yl] ester","Ingredient_formula": "C15H18O7","Ingredient_Smile": "CC1C(C(C(C(O1)OC(=O)C=CC2=CC=C(C=C2)O)O)O)O","Ingredient_weight": "310.3","OB_score": "25.76914445","CAS_id": "102719-86-8","SymMap_id": "SMIT13680","TCMID_id": "NA","TCMSP_id": "MOL012968","TCM_ID_id": "NA","PubChem_id": "6438942","DrugBank_id": "NA"}
1-o-cis-cinnamoyl-β-d-glucopyranose
{"Ingredient_id": "HBIN002864","Ingredient_name": "1-o-cis-cinnamoyl-\u03b2-d-glucopyranose","Alias": "NA","Ingredient_formula": "C15H18O7","Ingredient_Smile": "C1=CC=C(C=C1)C=CC(=O)OC2C(C(C(C(O2)CO)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "3704","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
1-o-trans-cinnamoyl-β-d-glucopyranose
{"Ingredient_id": "HBIN002933","Ingredient_name": "1-o-trans-cinnamoyl-\u03b2-d-glucopyranose","Alias": "NA","Ingredient_formula": "C15H18O7","Ingredient_Smile": "C1=CC=C(C=C1)C=CC(=O)OC2C(C(C(C(O2)CO)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "3705","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2,3-dehydroneomajucin
{"Ingredient_id": "HBIN003957","Ingredient_name": "2,3-dehydroneomajucin","Alias": "NA","Ingredient_formula": "C15H18O7","Ingredient_Smile": "CC1C=CC2(C13CC(C4(C2(COC4=O)C)O)OC(=O)C3O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "4952","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2-Cinnamoyl-glucose
{"Ingredient_id": "HBIN005460","Ingredient_name": "2-Cinnamoyl-glucose","Alias": "2-cinnamoyl-glucose; (E)-3-phenylacrylic acid [(2R,3R,4S,5S,6R)-2,4,5-trihydroxy-6-methylol-tetrahydropyran-3-yl] ester; (E)-3-phenylprop-2-enoic acid [(2R,3R,4S,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)-3-tetrahydropyranyl] ester; [(2R,3R,4S,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)tetrahydropyran-3-yl] (E)-3-phenylprop-2-enoate; [(2R,3R,4S,5S,6R)-2,4,5-trihydroxy-6-(hydroxymethyl)oxan-3-yl] (E)-3-phenylprop-2-enoate","Ingredient_formula": "C15H18O7","Ingredient_Smile": "C1=CC=C(C=C1)C=CC(=O)C(C=O)(C(C(C(CO)O)O)O)O","Ingredient_weight": "310.3 g/mol","OB_score": "17.0231529","CAS_id": "NA","SymMap_id": "SMIT04518;SMIT14680","TCMID_id": "3706","TCMSP_id": "MOL002232","TCM_ID_id": "NA","PubChem_id": "129650403","DrugBank_id": "NA"}
2-oxo-6-deoxyneoanisatin
{"Ingredient_id": "HBIN006278","Ingredient_name": "2-oxo-6-deoxyneoanisatin","Alias": "NA","Ingredient_formula": "C15H18O7","Ingredient_Smile": "CC1C2CC3(C(C(=O)CC3(C14COC4=O)O)C)C(C(=O)O2)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "25397","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(2s)-hydroxy-3,4-dehydroneomajucin
{"Ingredient_id": "HBIN006812","Ingredient_name": "(2s)-hydroxy-3,4-dehydroneomajucin","Alias": "NA","Ingredient_formula": "C15H18O7","Ingredient_Smile": "CC1C(C=C2C13CC(C4(C2(COC4=O)C)O)OC(=O)C3O)O","Ingredient_weight": "310.3 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "9974","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "21629990","DrugBank_id": "NA"}
3-oxo-6-deoxyneoanisatin
{"Ingredient_id": "HBIN009409","Ingredient_name": "3-oxo-6-deoxyneoanisatin","Alias": "NA","Ingredient_formula": "C15H18O7","Ingredient_Smile": "CC1C2CC3(C(C(=O)CC3(C14COC4=O)O)C)C(C(=O)O2)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "16300","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
6- o -cinnamoylglucose
{"Ingredient_id": "HBIN012652","Ingredient_name": "6- o -cinnamoylglucose","Alias": "NA","Ingredient_formula": "C15H18O7","Ingredient_Smile": "NA","Ingredient_weight": "310.3","OB_score": "NA","CAS_id": "64461-84-3","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7637","PubChem_id": "NA","DrugBank_id": "NA"}
