Exact Mass: 404.13618360000004
Exact Mass Matches: 404.13618360000004
Found 228 metabolites which its exact mass value is equals to given mass value 404.13618360000004,
within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error
0.001 dalton.
Feretoside
C17H24O11 (404.13185539999995)
Scandoside methyl ester is a terpene glycoside. Scandoside methyl ester is a natural product found in Feretia apodanthera, Gardenia jasminoides, and other organisms with data available.
Gardenoside
C17H24O11 (404.13185539999995)
A cyclopentapyran that is 7-deoxyloganin with a methyl and hydrogen replaced by hydroxy and hydroxymethyl groups at position 7. Gardenoside is a natural product found in Gardenia jasminoides, Catunaregam obovata, and other organisms with data available. Gardenoside is a natural compound found in Gardenia fruits, with hepatoprotective properties. Gardenoside suppresses the pain of chronic constriction injury by regulating the P2X3 and P2X7 receptors. Gardenoside has an inhibitory effect on free fatty acids (FFA)-induced cellular steatosis[1][2]. Gardenoside is a natural compound found in Gardenia fruits, with hepatoprotective properties. Gardenoside suppresses the pain of chronic constriction injury by regulating the P2X3 and P2X7 receptors. Gardenoside has an inhibitory effect on free fatty acids (FFA)-induced cellular steatosis[1][2]. Gardenoside is a natural compound found in Gardenia fruits, with hepatoprotective properties. Gardenoside suppresses the pain of chronic constriction injury by regulating the P2X3 and P2X7 receptors. Gardenoside has an inhibitory effect on free fatty acids (FFA)-induced cellular steatosis[1][2].
Oleoside 11-methyl ester
C17H24O11 (404.13185539999995)
Oleoside 11-methyl ester is found in herbs and spices. Oleoside 11-methyl ester is a constituent of Jasminum sambac (Arabian jasmine). Constituent of Jasminum sambac (Arabian jasmine). Oleoside 11-methyl ester is found in tea, olive, and herbs and spices.
Bentiromide
Bentiromide is a peptide used as a screening test for exocrine pancreatic insufficiency and to monitor the adequacy of supplemental pancreatic therapy. It is given by mouth as a noninvasive test. The amount of 4-aminobenzoic acid and its metabolites excreted in the urine is taken as a measure of the chymotrypsin-secreting activity of the pancreas. Headache and gastrointestinal disturbances have been reported in patients taking bentiromide. Bentiromide is not available in the U.S. or Canada (It was withdrawn in the US in October 1996). V - Various > V04 - Diagnostic agents > V04C - Other diagnostic agents > V04CK - Tests for pancreatic function D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents Bentiromide is a peptide that is broken down in the pancreas by chymotrypsin. The bentiromide test is an excellent means of confirming the diagnosis of pancreatic exocrine insufficiency by outpatient test of chymotrypsin function[1].
Scandoside methyl ester
C17H24O11 (404.13185539999995)
1,3-Benzodioxolane-5-carboxylicacid4'-benzyloxy-3'-methoxybenzylidenehydrazide
Gardenoside
C17H24O11 (404.13185539999995)
N-((1,2,3,5,6,7-Hexahydro-s-indacen-4-yl)carbamoyl)-4-(2-hydroxypropan-2-yl)furan-2-sulfonamide
Secoxyloganin
C17H24O11 (404.13185539999995)
Hastatoside
C17H24O11 (404.13185539999995)
Hastatoside is an iridoid monoterpenoid with formula C17H24O11 that is isolated from several plants including Verbena officinalis and exhibits a sleep-promoting effect. It has a role as a plant metabolite and a hepatoprotective agent. It is a beta-D-glucoside, an iridoid monoterpenoid, a cyclopentapyran, a monosaccharide derivative, a monoterpene glycoside, an alpha,beta-unsaturated carboxylic ester and a methyl ester. Hastatoside is a natural product found in Penstemon grandiflorus, Penstemon nitidus, and other organisms with data available. Hastatoside is a member of the class of compounds known as iridoid o-glycosides. Iridoid o-glycosides are iridoid monoterpenes containing a glycosyl (usually a pyranosyl) moiety linked to the iridoid skeleton. Hastatoside is soluble (in water) and a very weakly acidic compound (based on its pKa). Hastatoside can be found in common verbena, which makes hastatoside a potential biomarker for the consumption of this food product. Hastatoside is an iridoid glycoside that is isolated from Verbena officinalis and has a role in promoting sleep[1]. Hastatoside is an iridoid glycoside that is isolated from Verbena officinalis and has a role in promoting sleep[1].
Pallidol 3, 3'-diglucoside
C17H24O11 (404.13185539999995)
65J8K23L9L
C17H24O11 (404.13185539999995)
Secoxyloganin is a secoiridoid glycoside that is [(2R,3R,4S)-2-hydroxy-5-(methoxycarbonyl)-3-vinyl-3,4-dihydro-2H-pyran-4-yl]acetic acid in which the anometric hydroxy group has been converted to the corresponding beta-D-glucoside. It has been isolated from several plant species and exhibits antioxidant and anti-allergic properties. It has a role as a plant metabolite, an antioxidant and an anti-allergic agent. It is a methyl ester, a member of pyrans, an enoate ester, a beta-D-glucoside, a monosaccharide derivative, a dicarboxylic acid monoester and a secoiridoid glycoside. It is a conjugate acid of a secoxyloganin(1-). Secoxyloganin is a natural product found in Lonicera japonica, Phillyrea latifolia, and other organisms with data available. See also: Lonicera japonica flower (part of). A secoiridoid glycoside that is [(2R,3R,4S)-2-hydroxy-5-(methoxycarbonyl)-3-vinyl-3,4-dihydro-2H-pyran-4-yl]acetic acid in which the anometric hydroxy group has been converted to the corresponding beta-D-glucoside. It has been isolated from several plant species and exhibits antioxidant and anti-allergic properties. Secoxyloganin, isolated from Lonicera japonica Thunb, inhibits the blood flow (BF) decrease. Secoxyloganin has allergy-preventive activity[1]. Secoxyloganin, isolated from Lonicera japonica Thunb, inhibits the blood flow (BF) decrease. Secoxyloganin has allergy-preventive activity[1].
Hastatoside
C17H24O11 (404.13185539999995)
Hastatoside is an iridoid monoterpenoid with formula C17H24O11 that is isolated from several plants including Verbena officinalis and exhibits a sleep-promoting effect. It has a role as a plant metabolite and a hepatoprotective agent. It is a beta-D-glucoside, an iridoid monoterpenoid, a cyclopentapyran, a monosaccharide derivative, a monoterpene glycoside, an alpha,beta-unsaturated carboxylic ester and a methyl ester. Hastatoside is a natural product found in Penstemon grandiflorus, Penstemon nitidus, and other organisms with data available. An iridoid monoterpenoid with formula C17H24O11 that is isolated from several plants including Verbena officinalis and exhibits a sleep-promoting effect. Hastatoside is an iridoid glycoside that is isolated from Verbena officinalis and has a role in promoting sleep[1]. Hastatoside is an iridoid glycoside that is isolated from Verbena officinalis and has a role in promoting sleep[1].
6A-Hydroxygeniposide
C17H24O11 (404.13185539999995)
Deacetyl asperulosidic acid methyl ester is a natural product found in Gardenia jasminoides, Rothmannia globosa, and other organisms with data available. Methyl deacetylasperulosidate is an iridoid and shows purgative effects in mice and lowers the blood glucose level in normal mice[1]. Methyl deacetylasperulosidate is an iridoid and shows purgative effects in mice and lowers the blood glucose level in normal mice[1].
Methyl deacetylasperulosidate
C17H24O11 (404.13185539999995)
Methyl deacetylasperulosidate is an iridoid and shows purgative effects in mice and lowers the blood glucose level in normal mice[1]. Methyl deacetylasperulosidate is an iridoid and shows purgative effects in mice and lowers the blood glucose level in normal mice[1].
pyrocatechol 1-O-beta-D-xylopyranosyl(1-6)-beta-D-glucopyranoside
C17H24O11 (404.13185539999995)
4-Bromobenzoyl-7beta-2,6,6,8-Tetramethyltricyclo[6.2.1.01,5]undecan-7-ol-7beta
7??,8??-Epoxy-8??-dihydrogeniposide
C17H24O11 (404.13185539999995)
catechol O-beta-D-(6-O-beta-D-apiofuranosyl)glucopyranoside
C17H24O11 (404.13185539999995)
(rel)-(1aR,1bR,5R,5aR,6S,6aR)-5-(beta-D-glucopyranosyloxy)-1a,1b,5,5a,6,6a-hexahydro-6-hydroxy-6-methyloxireno[3,4]cyclopenta[1,2-c]pyran-2-carboxylic acid methyl ester|(rel)-(1aR,1bR,5R,5aR,6S,6aR)-5-(beta-D-glucopyranosyloxy)-1a,1b,5,5a,6,6a-hexahydro-6-hydroxy-8-methyloxireno[3,4]cyclopenta[1,2-c]pyran-2-carboxylic acid methyl ester|lamiuamplexoside A
C17H24O11 (404.13185539999995)
furan-2-carbonyl C-(6-O-beta-L-rhamnopyranosyl)-beta-glucopyranoside|scleropentaside B
C17H24O11 (404.13185539999995)
Theveridoside
C17H24O11 (404.13185539999995)
Theviridoside is a natural product found in Lantana camara, Recordia reitzii, and other organisms with data available.
10-Hydroxy majoroside
C17H24O11 (404.13185539999995)
methyloleoside
C17H24O11 (404.13185539999995)
Oleoside 11-methyl ester is a natural product found in Jasminum nudiflorum, Picconia excelsa, and other organisms with data available.
methyl 5-hydroxy-7-(hydroxymethyl)-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate
C17H24O11 (404.13185539999995)
methyl 5-hydroxy-7-(hydroxymethyl)-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate
C17H24O11 (404.13185539999995)
Deacetylasperuloside acid methyl ester
C17H24O11 (404.13185539999995)
Methyl deacetylasperulosidate is an iridoid and shows purgative effects in mice and lowers the blood glucose level in normal mice[1]. Methyl deacetylasperulosidate is an iridoid and shows purgative effects in mice and lowers the blood glucose level in normal mice[1].
Secoxyloganin
C17H24O11 (404.13185539999995)
Secoxyloganin, isolated from Lonicera japonica Thunb, inhibits the blood flow (BF) decrease. Secoxyloganin has allergy-preventive activity[1]. Secoxyloganin, isolated from Lonicera japonica Thunb, inhibits the blood flow (BF) decrease. Secoxyloganin has allergy-preventive activity[1].
C17H24O11_Cyclopenta[c]pyran-4-carboxylic acid, 1-(hexopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-4a-hydroxy-7-methyl-5-oxo-, methyl ester
C17H24O11 (404.13185539999995)
C17H24O11_[2-(beta-D-Glucopyranosyloxy)-5-(methoxycarbonyl)-3-vinyl-3,4-dihydro-2H-pyran-4-yl]acetic acid
C17H24O11 (404.13185539999995)
C17H24O11_Cyclopenta[c]pyran-4,7-dicarboxylic acid, 1-(beta-D-glucopyranosyloxy)-1,4a,5,6,7,7a-hexahydro-, 4-methyl ester, (1S,4aS,7S,7aS)
C17H24O11 (404.13185539999995)
methyl (1S,4aR,7aR)-4a-hydroxy-7-(hydroxymethyl)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5,7a-dihydro-1H-cyclopenta[c]pyran-4-carboxylate
C17H24O11 (404.13185539999995)
2-[3-ethenyl-5-methoxycarbonyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-3,4-dihydro-2H-pyran-4-yl]acetic acid
C17H24O11 (404.13185539999995)
methyl (1S,4aR,7aR)-4a-hydroxy-7-(hydroxymethyl)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5,7a-dihydro-1H-cyclopenta[c]pyran-4-carboxylate_major
C17H24O11 (404.13185539999995)
Ala Cys Asp Pro
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Bentiromide
V - Various > V04 - Diagnostic agents > V04C - Other diagnostic agents > V04CK - Tests for pancreatic function D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents Bentiromide is a peptide that is broken down in the pancreas by chymotrypsin. The bentiromide test is an excellent means of confirming the diagnosis of pancreatic exocrine insufficiency by outpatient test of chymotrypsin function[1].
Oleoside 11-methyl ester
C17H24O11 (404.13185539999995)
A secoiridoid glycoside that is [(2R,3E,4S)-3-ethylidene-2-hydroxy-5-(methoxycarbonyl)-3,4-dihydro-2H-pyran-4-yl]acetic acid in which the anometric hydroxy group has been converted to the corresponding beta-D-glucoside. It has been isolated from several plant species including Olea europaea.
[2-(?-D-Glucopyranosyloxy)-5-(methoxycarbonyl)-3-vinyl-3,4-dihydro-2H-pyran-4-yl]acetic acid
C17H24O11 (404.13185539999995)
2-[4-[3-(3-chloropyrido[3,2-b][1,4]benzothiazin-10-yl)propyl]piperazin-1-yl]ethanol
Ruxolitinib phosphate
C17H21N6O4P (404.13618360000004)
C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C1967 - Tyrosine Kinase Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor > C172200 - JAK Inhibitor C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C125450 - JAK2 Inhibitor COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
N-[3-Fluoro-4-[6-(2-methyl-2H-tetrazol-5-yl)-3-pyridinyl]phenyl]carbamic acid phenylmethyl ester
C21H17FN6O2 (404.13969539999994)
Deuruxolitinib phosphate
C17H21N6O4P (404.13618360000004)
C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor > C129824 - Antineoplastic Protein Inhibitor C471 - Enzyme Inhibitor > C1404 - Protein Kinase Inhibitor > C1967 - Tyrosine Kinase Inhibitor C471 - Enzyme Inhibitor > C129825 - Antineoplastic Enzyme Inhibitor > C172200 - JAK Inhibitor C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C125450 - JAK2 Inhibitor
1,3-Benzodioxolane-5-carboxylic acid 4-benzyloxy-3-methoxybenzylidene hydrazide
(E)-3-[4-(1,3-benzodioxol-5-ylmethyl)piperazin-1-yl]-2-(1,3-benzothiazol-2-yl)prop-2-enenitrile
N-Benzoyl-L-tyrosyl-p-aminobenzoic acid
D019995 - Laboratory Chemicals > D007202 - Indicators and Reagents
Deacetyl asperulosidic acid methyl ester
C17H24O11 (404.13185539999995)
Methyl deacetylasperulosidate is an iridoid and shows purgative effects in mice and lowers the blood glucose level in normal mice[1]. Methyl deacetylasperulosidate is an iridoid and shows purgative effects in mice and lowers the blood glucose level in normal mice[1].
Pallidol 3, 3'-diglucoside
C17H24O11 (404.13185539999995)
Methyl 4a-hydroxy-7-(hydroxymethyl)-1-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-5,7a-dihydro-1H-cyclopenta[c]pyran-4-carboxylate
C17H24O11 (404.13185539999995)
3-[(2E)-2-[(4-Benzoyloxy-3-ethoxyphenyl)methylidene]hydrazinyl]benzoic acid
3-[3-[(5-ethyl-[1,2,4]triazino[5,6-b]indol-3-yl)thio]propyl]-1H-benzimidazol-2-one
[4-[6,8-Dimethyl-2-(trifluoromethyl)-4-quinazolinyl]-1-piperazinyl]-(2-furanyl)methanone
5-[1-[(2-chlorophenyl)methyl]-2,5-dimethyl-3-pyrrolyl]-N-(1-methoxypropan-2-yl)-6H-1,3,4-thiadiazin-2-amine
1-(4-amino-1,2,5-oxadiazol-3-yl)-N-[(E)-(2-methoxyphenyl)methylideneamino]-5-phenyltriazole-4-carboxamide
C19H16N8O3 (404.13453059999995)
5-acetamido-2,6-anhydro-9-(4-carboxybutanamido)-3,5,9-trideoxy-D-glycero-D-galacto-non-2-enonic acid
1-pentyl-3-(3-O-sulfo-beta-D-galactosyl)-sn-glycerol
C14H28O11S (404.13522580000006)
2-mercapto-N-[(4-methoxyphenyl)methyl]-1-(4-methylphenyl)-3-imidazo[1,2-a]pyridin-4-iumcarboxamide
C23H22N3O2S+ (404.14326520000003)
(5E)-2-Amino-5-[[3-(4-ethoxy-3-methylphenyl)-1-phenylpyrazol-4-yl]methylidene]-1,3-thiazol-4-one
D-Glycero-D-gulo-Heptitol, 2,6-anhydro-, pentaacetate
C17H24O11 (404.13185539999995)
Glucopyranose, 3-deoxy-3-(hydroxymethyl)-, pentaacetate, alpha-D-
C17H24O11 (404.13185539999995)
N-[(3-methoxy-4-phenylmethoxyphenyl)methylideneamino]-1,3-benzodioxole-5-carboxamide
methyl (1s,4ar,5r,7ar)-5-hydroxy-7-(hydroxymethyl)-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,7ah-cyclopenta[c]pyran-4-carboxylate
C17H24O11 (404.13185539999995)
methyl (1s,4as,8r,8as)-8-methyl-6-oxo-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,8h,8ah-pyrano[3,4-c]pyran-4-carboxylate
C17H24O11 (404.13185539999995)
methyl (1s,4ar,7r,7as)-7-hydroxy-7-(hydroxymethyl)-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,7ah-cyclopenta[c]pyran-4-carboxylate
C17H24O11 (404.13185539999995)
(2r,3s,4s,5r,6s)-2-({[(2r,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-(4-hydroxyphenoxy)oxane-3,4,5-triol
C17H24O11 (404.13185539999995)
methyl (1s,4as,7r,7ar)-7-(hydroxymethyl)-5-oxo-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,6h,7h,7ah-cyclopenta[c]pyran-4-carboxylate
C17H24O11 (404.13185539999995)
(1r,2s,3r,4r,5r,6s)-2,3,4,5-tetrakis(acetyloxy)-6-methoxycyclohexyl acetate
C17H24O11 (404.13185539999995)
2-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-(4-hydroxyphenoxy)oxane-3,4,5-triol
C17H24O11 (404.13185539999995)
[3-ethylidene-5-(methoxycarbonyl)-2-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,4-dihydropyran-4-yl]acetic acid
C17H24O11 (404.13185539999995)
(2s,3r,4s,5s,6r)-2-(2-hydroxyphenoxy)-6-({[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxane-3,4,5-triol
C17H24O11 (404.13185539999995)
[1R-(1a,4aa,8a,8aa)]-8-(b-D-glucopyranosyloxy)-4,4a,8,8a-tetrahydro-1-methyl-3-oxo-1H,3H-Pyrano[3,4-c]pyran-5-carboxylic acid, methyl ester
C17H24O11 (404.13185539999995)
{"Ingredient_id": "HBIN003016","Ingredient_name": "[1R-(1a,4aa,8a,8aa)]-8-(b-D-glucopyranosyloxy)-4,4a,8,8a-tetrahydro-1-methyl-3-oxo-1H,3H-Pyrano[3,4-c]pyran-5-carboxylic acid, methyl ester","Alias": "NA","Ingredient_formula": "C17H24O11","Ingredient_Smile": "NA","Ingredient_weight": "404.37","OB_score": "4.187106429","CAS_id": "115729-53-8","SymMap_id": "SMIT06952","TCMID_id": "NA","TCMSP_id": "MOL005152","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
[1R-(1a,4aa,8a,8aa)]-8-(b-D-glucopyranosyloxy)-4,4a,8,8a-tetrahydro-1-methyl-3-oxo-1H,3H-Pyrano[3,4-c]pyran-5-carboxylic acid, methyl ester_qt
C17H24O11 (404.13185539999995)
{"Ingredient_id": "HBIN003017","Ingredient_name": "[1R-(1a,4aa,8a,8aa)]-8-(b-D-glucopyranosyloxy)-4,4a,8,8a-tetrahydro-1-methyl-3-oxo-1H,3H-Pyrano[3,4-c]pyran-5-carboxylic acid, methyl ester_qt","Alias": "NA","Ingredient_formula": "C17H24O11","Ingredient_Smile": "NA","Ingredient_weight": "404.37","OB_score": "65.31305526","CAS_id": "115729-53-8","SymMap_id": "SMIT06953","TCMID_id": "NA","TCMSP_id": "MOL005153","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
5-methoxygeniposidic acid
C17H24O11 (404.13185539999995)
{"Ingredient_id": "HBIN011755","Ingredient_name": "5-methoxygeniposidic acid","Alias": "NA","Ingredient_formula": "C17H24O11","Ingredient_Smile": "NA","Ingredient_weight": "404.37","OB_score": "NA","CAS_id": "134515-70-1","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7659","PubChem_id": "NA","DrugBank_id": "NA"}
6-methoxyginiposidicacid
C17H24O11 (404.13185539999995)
{"Ingredient_id": "HBIN012524","Ingredient_name": "6-methoxyginiposidicacid","Alias": "NA","Ingredient_formula": "C17H24O11","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "13933","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
7,8-Dehydropenstemoside
C17H24O11 (404.13185539999995)
{"Ingredient_id": "HBIN012958","Ingredient_name": "7,8-Dehydropenstemoside","Alias": "7, 8-dehydropenstemoside; CHEMBL517923; 5,9-epi-7,8-didehydropenstemoside; 7,8-dehydropenstemoside","Ingredient_formula": "C17H24O11","Ingredient_Smile": "CC1=CC(C2(C1C(OC=C2C(=O)OC)OC3C(C(C(C(O3)CO)O)O)O)O)O","Ingredient_weight": "404.4 g/mol","OB_score": "3.408230825","CAS_id": "NA","SymMap_id": "SMIT01148","TCMID_id": "35398;4958","TCMSP_id": "MOL005496","TCM_ID_id": "NA","PubChem_id": "11338644","DrugBank_id": "NA"}
7β,8β-epoxy-8α-dihydrogeniposide
C17H24O11 (404.13185539999995)
{"Ingredient_id": "HBIN013089","Ingredient_name": "7\u03b2,8\u03b2-epoxy-8\u03b1-dihydrogeniposide","Alias": "NA","Ingredient_formula": "C17H24O11","Ingredient_Smile": "COC(=O)C1=COC(C2C1CC3C2(O3)CO)OC4C(C(C(C(O4)CO)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT15278","TCMID_id": "7069","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
8-o-acetylclandonoside
C17H24O11 (404.13185539999995)
{"Ingredient_id": "HBIN013840","Ingredient_name": "8-o-acetylclandonoside","Alias": "NA","Ingredient_formula": "C17H24O11","Ingredient_Smile": "CC(=O)OC1(CC(C2(C1C(OC=C2)OC3C(C(=O)C(C(O3)CO)O)O)O)O)C","Ingredient_weight": "404.4 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "356","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "100982868","DrugBank_id": "NA"}
methyl (1s,2r,4r,5s,6s,7r)-5-hydroxy-5-methyl-7-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,8-dioxatricyclo[4.4.0.0²,⁴]dec-9-ene-10-carboxylate
C17H24O11 (404.13185539999995)
(2r,3r,4r,5r,6s)-2-{[(2r,3s,4s,5r,6r)-6-(furan-2-carbonyl)-3,4,5-trihydroxyoxan-2-yl]methoxy}-6-methyloxane-3,4,5-triol
C17H24O11 (404.13185539999995)
7-(hydroxymethyl)-5-methoxy-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,7ah-cyclopenta[c]pyran-4-carboxylic acid
C17H24O11 (404.13185539999995)
methyl (1s,4ar,7ar)-4a-hydroxy-7-(hydroxymethyl)-1-{[(2r,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,5h,7ah-cyclopenta[c]pyran-4-carboxylate
C17H24O11 (404.13185539999995)
methyl (1r,4s,7s,8s,9s,11s)-4-hydroxy-9-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,10-dioxatricyclo[5.3.1.0⁴,⁸]undec-5-ene-11-carboxylate
C17H24O11 (404.13185539999995)
methyl 4a-hydroxy-7-(hydroxymethyl)-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,5h,7ah-cyclopenta[c]pyran-4-carboxylate
C17H24O11 (404.13185539999995)
methyl (1s,4ar,7s,7ar)-4a-hydroxy-7-methyl-5-oxo-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,6h,7h,7ah-cyclopenta[c]pyran-4-carboxylate
C17H24O11 (404.13185539999995)
methyl (1s,2s,3s,7s,9r)-3-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4,10,12-trioxatricyclo[7.2.1.0²,⁷]dodec-5-ene-6-carboxylate
C17H24O11 (404.13185539999995)
methyl (1s,4as,6s)-6-hydroxy-7-(hydroxymethyl)-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,6h-cyclopenta[c]pyran-4-carboxylate
C17H24O11 (404.13185539999995)
[(1s,4as,5r,7ar)-4a,5-dihydroxy-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,5h,7ah-cyclopenta[c]pyran-7-yl]methyl acetate
C17H24O11 (404.13185539999995)
(1s,4as,5r,7s,7as)-1-{[(2s,3s,5r,6r)-3,5-dihydroxy-6-(hydroxymethyl)-4-oxooxan-2-yl]oxy}-4a,5-dihydroxy-7-methyl-1h,5h,6h,7ah-cyclopenta[c]pyran-7-yl acetate
C17H24O11 (404.13185539999995)
[(2s,3e,4r)-3-ethylidene-5-(methoxycarbonyl)-2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,4-dihydropyran-4-yl]acetic acid
C17H24O11 (404.13185539999995)
(2r,3s,4s,5r,6s)-2-({[(2r,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-(2-hydroxyphenoxy)oxane-3,4,5-triol
C17H24O11 (404.13185539999995)
2-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-(2-hydroxyphenoxy)oxane-3,4,5-triol
C17H24O11 (404.13185539999995)
2-(2-hydroxyphenoxy)-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxane-3,4,5-triol
C17H24O11 (404.13185539999995)
[(2s,3e,4s)-3-ethylidene-5-(methoxycarbonyl)-2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,4-dihydropyran-4-yl]acetic acid
C17H24O11 (404.13185539999995)
methyl 5-hydroxy-5-methyl-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,8-dioxatricyclo[4.4.0.0²,⁴]dec-9-ene-10-carboxylate
C17H24O11 (404.13185539999995)
methyl 8-methyl-6-oxo-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,8h,8ah-pyrano[3,4-c]pyran-4-carboxylate
C17H24O11 (404.13185539999995)
methyl (1r,4ar,7s,7ar)-4a-hydroxy-7-methyl-5-oxo-1-{[(2r,3s,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,6h,7h,7ah-cyclopenta[c]pyran-4-carboxylate
C17H24O11 (404.13185539999995)
1-[(2-hydroxyphenazin-1-yl)methyl]phenazin-2-ol
C25H16N4O2 (404.12731959999996)
methyl (1s,4as,5s,6r,7as)-5,6-dihydroxy-7-methylidene-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
C17H24O11 (404.13185539999995)
methyl (1s,4as,7s,7ar)-7-(hydroxymethyl)-5-oxo-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,6h,7h,7ah-cyclopenta[c]pyran-4-carboxylate
C17H24O11 (404.13185539999995)
methyl (1s,4as,7s,7as)-7-hydroxy-7-(hydroxymethyl)-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,7ah-cyclopenta[c]pyran-4-carboxylate
C17H24O11 (404.13185539999995)
methyl (1s,2r,4s,5s,6s,10s)-5-hydroxy-2-methyl-10-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,9-dioxatricyclo[4.4.0.0²,⁴]dec-7-ene-7-carboxylate
C17H24O11 (404.13185539999995)
methyl (1s,4ar,7r,7ar)-4a-hydroxy-7-methyl-5-oxo-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,6h,7h,7ah-cyclopenta[c]pyran-4-carboxylate
C17H24O11 (404.13185539999995)
methyl (1s,4as,5s,7as)-5-hydroxy-7-(hydroxymethyl)-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,7ah-cyclopenta[c]pyran-4-carboxylate
C17H24O11 (404.13185539999995)
methyl 6-hydroxy-7-(hydroxymethyl)-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,6h-cyclopenta[c]pyran-4-carboxylate
C17H24O11 (404.13185539999995)
(4a,5-dihydroxy-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,5h,7ah-cyclopenta[c]pyran-7-yl)methyl acetate
C17H24O11 (404.13185539999995)
methyl (4ar,7s,7as)-7-hydroxy-7-(hydroxymethyl)-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,7ah-cyclopenta[c]pyran-4-carboxylate
C17H24O11 (404.13185539999995)
(2s,3r,4s,5s,6r)-2-(2-hydroxyphenoxy)-6-({[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxane-3,4,5-triol
C17H24O11 (404.13185539999995)
[(2s,3r,4s)-3-ethenyl-5-(methoxycarbonyl)-2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2h-pyran-4-yl]acetic acid
C17H24O11 (404.13185539999995)
methyl (1s,4as,5s,6s,7as)-5,6-dihydroxy-7-methylidene-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
C17H24O11 (404.13185539999995)
methyl 7-(hydroxymethyl)-5-oxo-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,6h,7h,7ah-cyclopenta[c]pyran-4-carboxylate
C17H24O11 (404.13185539999995)
methyl (1s,4as,7s,7as)-7-hydroxy-7-(hydroxymethyl)-1-{[(2r,3r,4r,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,7ah-cyclopenta[c]pyran-4-carboxylate
C17H24O11 (404.13185539999995)
methyl 5-hydroxy-2-methyl-10-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,9-dioxatricyclo[4.4.0.0²,⁴]dec-7-ene-7-carboxylate
C17H24O11 (404.13185539999995)
(5r,6s,8s,8as)-5-ethenyl-8a-hydroxy-8-methoxy-6-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3h,5h,6h,8h-pyrano[3,4-c]pyran-1-one
C17H24O11 (404.13185539999995)
methyl (1s,4as,8s,8as)-8-methyl-6-oxo-1-{[(2r,3s,4r,5s,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,8h,8ah-pyrano[3,4-c]pyran-4-carboxylate
C17H24O11 (404.13185539999995)
methyl 2-(hydroxymethyl)-10-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,9-dioxatricyclo[4.4.0.0²,⁴]dec-7-ene-7-carboxylate
C17H24O11 (404.13185539999995)
(4r,5r,6s,8r)-5-ethenyl-4-hydroxy-8-methoxy-6-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3h,4h,5h,6h,8h-pyrano[3,4-c]pyran-1-one
C17H24O11 (404.13185539999995)
methyl (1r,4s,9s,11s)-4-hydroxy-9-{[(2r,3s,4r,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,10-dioxatricyclo[5.3.1.0⁴,⁸]undec-5-ene-11-carboxylate
C17H24O11 (404.13185539999995)
methyl (1s,4as,5s,7as)-4a,5-dihydroxy-7-methyl-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,5h,7ah-cyclopenta[c]pyran-4-carboxylate
C17H24O11 (404.13185539999995)
(2r,3s,4s,5r,6s)-5-{[(2s,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-2-(hydroxymethyl)-6-(4-hydroxyphenoxy)oxane-3,4-diol
C17H24O11 (404.13185539999995)
[(1s,4as,5r,7as)-4a,5-dihydroxy-1-{[(2r,3s,4r,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,5h,7ah-cyclopenta[c]pyran-7-yl]methyl acetate
C17H24O11 (404.13185539999995)
methyl 4-hydroxy-9-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,10-dioxatricyclo[5.3.1.0⁴,⁸]undec-5-ene-11-carboxylate
C17H24O11 (404.13185539999995)
methyl (1s,2s,4s,6s,10s)-2-(hydroxymethyl)-10-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,9-dioxatricyclo[4.4.0.0²,⁴]dec-7-ene-7-carboxylate
C17H24O11 (404.13185539999995)
methyl (1s,4ar,7ar)-4a-hydroxy-7-(hydroxymethyl)-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,5h,7ah-cyclopenta[c]pyran-4-carboxylate
C17H24O11 (404.13185539999995)
5-ethenyl-4-(2-methoxy-2-oxoethyl)-6-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-5,6-dihydro-4h-pyran-3-carboxylic acid
C17H24O11 (404.13185539999995)
(1s,4as,7s,7as)-4-(methoxycarbonyl)-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyran-7-carboxylic acid
C17H24O11 (404.13185539999995)
methyl 5,6-dihydroxy-7-methylidene-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-4-carboxylate
C17H24O11 (404.13185539999995)
4-(methoxycarbonyl)-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyran-7-carboxylic acid
C17H24O11 (404.13185539999995)
methyl (1s,4as,5r,7as)-4a,5-dihydroxy-7-methyl-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,5h,7ah-cyclopenta[c]pyran-4-carboxylate
C17H24O11 (404.13185539999995)
(4s,5r,6s)-5-ethenyl-4-(2-methoxy-2-oxoethyl)-6-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-5,6-dihydro-4h-pyran-3-carboxylic acid
C17H24O11 (404.13185539999995)
(1s,4as,8as)-8-methyl-6-oxo-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,8h,8ah-pyrano[3,4-c]pyran-4-yl acetate
C17H24O11 (404.13185539999995)
methyl (1r,4s,7s,8s,9s,11r)-4-hydroxy-9-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,10-dioxatricyclo[5.3.1.0⁴,⁸]undec-5-ene-11-carboxylate
C17H24O11 (404.13185539999995)
(1s,4as,5s,7as)-7-(hydroxymethyl)-5-methoxy-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,7ah-cyclopenta[c]pyran-4-carboxylic acid
C17H24O11 (404.13185539999995)
6-hydroxy-2-methyl-10-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,9-dioxatricyclo[4.4.0.0²,⁴]dec-7-en-5-yl acetate
C17H24O11 (404.13185539999995)
5-{[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-2-(hydroxymethyl)-6-(4-hydroxyphenoxy)oxane-3,4-diol
C17H24O11 (404.13185539999995)
methyl (1r,4as,7as)-4a-hydroxy-7-(hydroxymethyl)-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,5h,7ah-cyclopenta[c]pyran-4-carboxylate
C17H24O11 (404.13185539999995)
methyl (1s,4as,8s,8as)-8-methyl-6-oxo-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,5h,8h,8ah-pyrano[3,4-c]pyran-4-carboxylate
C17H24O11 (404.13185539999995)
methyl (1s,4ar,5r,7ar)-4a,5-dihydroxy-7-methyl-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,5h,7ah-cyclopenta[c]pyran-4-carboxylate
C17H24O11 (404.13185539999995)
methyl 4a,5-dihydroxy-7-methyl-1-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,5h,7ah-cyclopenta[c]pyran-4-carboxylate
C17H24O11 (404.13185539999995)
(5r,6r,8s,8as)-5-ethenyl-8a-hydroxy-8-methoxy-6-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3h,5h,6h,8h-pyrano[3,4-c]pyran-1-one
C17H24O11 (404.13185539999995)
[(2r,3e,4r)-3-ethylidene-5-(methoxycarbonyl)-2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,4-dihydropyran-4-yl]acetic acid
C17H24O11 (404.13185539999995)
methyl (1s,4ar,7s,7as)-7-hydroxy-7-(hydroxymethyl)-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,4ah,7ah-cyclopenta[c]pyran-4-carboxylate
C17H24O11 (404.13185539999995)
[(2s,3r,4r)-3-ethenyl-5-(methoxycarbonyl)-2-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,4-dihydro-2h-pyran-4-yl]acetic acid
C17H24O11 (404.13185539999995)
(1s,2r,4s,5r,6s,10s)-6-hydroxy-2-methyl-10-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,9-dioxatricyclo[4.4.0.0²,⁴]dec-7-en-5-yl acetate
C17H24O11 (404.13185539999995)
2,3,4,5-tetrakis(acetyloxy)-6-methoxycyclohexyl acetate
C17H24O11 (404.13185539999995)
methyl 3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4,10,12-trioxatricyclo[7.2.1.0²,⁷]dodec-5-ene-6-carboxylate
C17H24O11 (404.13185539999995)