Exact Mass: 508.23938419999996
Exact Mass Matches: 508.23938419999996
Found 307 metabolites which its exact mass value is equals to given mass value 508.23938419999996
,
within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error
0.001 dalton.
Argatroban
C23H36N6O5S (508.24677660000003)
Argatroban is a direct, selective thrombin inhibitor. The American College of Cardiologists (ACC) recommend using bivalirudin or argatroban in patients who have had, or at risk for, heparin induced thrombocytopenia (HIT) and are undergoing percutaneous coronary intervention. Argatroban is a non-heparin anticoagulant shown to both normalize platelet count in patients with HIT and prevent the formation of thrombi. Parental anticoagulants must be stopped and a baseline activated partial thromboplastin time must be obtained prior to administering argatroban. D004791 - Enzyme Inhibitors > D011480 - Protease Inhibitors > D015842 - Serine Proteinase Inhibitors D006401 - Hematologic Agents > D000925 - Anticoagulants > D000991 - Antithrombins D006401 - Hematologic Agents > D010975 - Platelet Aggregation Inhibitors
PD 123319
C31H32N4O3 (508.24742819999994)
D057911 - Angiotensin Receptor Antagonists > D057912 - Angiotensin II Type 2 Receptor Blockers D002317 - Cardiovascular Agents > D014662 - Vasoconstrictor Agents
Argatroban
C23H36N6O5S (508.24677660000003)
B - Blood and blood forming organs > B01 - Antithrombotic agents > B01A - Antithrombotic agents > B01AE - Direct thrombin inhibitors D004791 - Enzyme Inhibitors > D011480 - Protease Inhibitors > D015842 - Serine Proteinase Inhibitors D006401 - Hematologic Agents > D000925 - Anticoagulants > D000991 - Antithrombins COVID info from clinicaltrial, clinicaltrials, clinical trial, clinical trials C78275 - Agent Affecting Blood or Body Fluid > C263 - Anticoagulant Agent D006401 - Hematologic Agents > D010975 - Platelet Aggregation Inhibitors Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS
Mozambioside
Mozambioside is found in coffee and coffee products. Mozambioside is isolated from beans of arabica coffee (Coffea arabica) and wild coffee sp. (Coffea pseudozanguebariae). Isolated from beans of arabica coffee (Coffea arabica) and wild coffee species (Coffea pseudozanguebariae). Mozambioside is found in coffee and coffee products.
Gibberellin A37 glucosyl ester
Gibberellin A37 glucosyl ester (GA37 glucosyl ester) belongs to the class of organic compounds known as diterpene glycosides. These are diterpenoids in which an isoprene unit is glycosylated. Gibberellin A37 glucosyl ester is found in pulses. Gibberellin A37 glucosyl ester is a constituent of the seeds of Phaseolus vulgaris (kidney beans). Constituent of the seeds of Phaseolus vulgaris (kidney beans). Gibberellin A37 glucosyl ester is found in pulses, yellow wax bean, and green bean.
Acetyl-T2 Toxin
Acetyl-T2 Toxin is a metabolite of Fusarium graminearum, Fusarium poae and Fusarium sporotrichioides. Potential contaminant of cereals. Metabolite of Fusarium graminearum, Fusarium poae and Fusarium sporotrichioides. Potential contaminant of cereals. D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins
Cafamarine
Cafamarine is found in coffee and coffee products. Cafamarine occurs in coffee. Occurs in coffee. Cafamarine is found in coffee and coffee products.
1-[[4-(Dimethylamino)-3-methylphenyl]methyl]-5-(2,2-diphenylacetyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxylic acid
C31H32N4O3 (508.24742819999994)
D057911 - Angiotensin Receptor Antagonists > D057912 - Angiotensin II Type 2 Receptor Blockers D002317 - Cardiovascular Agents > D014662 - Vasoconstrictor Agents
(11S)-11-Benzyl-6-chloro-1,2,10,11,12,13,14,15,16,17,18,19-dodecahydro-5,9-methano-2,5,8,10,13,17-benzohexaazacyclohenicosine-3,24-dione
(1R,3R)-5-[(2E)-2-[(3As,7aS)-7a-methyl-1-[(Z,2R)-7,7,7-trifluoro-6-hydroxy-6-(trifluoromethyl)hept-4-en-2-yl]-3a,5,6,7-tetrahydro-3H-inden-4-ylidene]ethylidene]cyclohexane-1,3-diol
C26H34F6O3 (508.24120059999996)
Kushenol M
Kushenol M is a natural product found in Sophora flavescens with data available.
Tanariflavanone A
A hydroxyflavanone with a pyranochromane skeleton that is 3,4,7,8-tetrahydro-2H,6H-pyrano[3,2-g]chromen-6-one substituted by geminal methyl groups at position 2, hydroxy groups at positions 3 and 5 and a phenyl group at position 8 which in turn is substituted by a geranyl group at position 2 and hydroxy groups at positions 3 and 4. Isolated from Macaranga tanarius, it exhibits alleopathic effect.
Petalostemumol
Tanariflavanone C
A tetrahydroxyflavanone that is (2S)-flavanone substituted by hydroxy groups at positions 5,7, 3 and 4, a geranyl group at position 2 and a 2-hydroxy-3-methylbut-3-en-1yl group at position 6. Isolated from Macaranga tanarius, it exhibits radical scavenging activity.
[(3R,3aS,4R,6R,8S,9bR)-6-acetyloxy-4-butanoyloxy-3,3a-dihydroxy-3,6,9-trimethyl-2-oxo-4,5,6a,7,8,9b-hexahydroazuleno[4,5-b]furan-8-yl] (E)-2-methylbut-2-enoate
(12R)-12-cinnamoyloxy-3beta,5-dihydroxy-8,14-seco-5beta,17beta-pregn-6-ene-8,14,20-trione|cynaphyllogenin|Cynaphylloside
(4bS,8aS)-4b,5,6,8a,9,10-hexahydro-4-hydroxy-7-(hydroxymethyl)-2-(2-hydroxypropyl)-4b,8-dimethyl-10-oxophenanthren-3-yl beta-D-glucopyranoside|12-[(beta-D-glucopyranosyl)oxy]-11,16,18-trihydroxy-17(15->16)-18(4->3)-abeo-abieta-3,8,11,13-tetraen-7-one|clerodendranthuside C
(-)-(7S,7S,8R,8S,8R)-4,4-dihydroxy-3,3,5-trimethoxy-4,8-oxy-2,7-cyclo-8,8-sesquineolignan-7-ol
A neolignan isolated from the barks of Machilus robusta.
2beta,10beta,11alpha-triacetoxy-8alpha-(2-methylbutanoyloxy)-slov-3-enolide
1alpha,7beta-diacetoxy-5alpha-hydroxy-12alpha-methoxycass-13(15)-en-16,12-olide-17beta-carboxylate
4alpha,5alpha-diacetoxy-9alpha-benzoyloxy-7betaH-eudesman-1beta,2beta,11, 14-tetraol
9alpha-(2-methylbutyryloxy)-4beta,15-epoxyrepandanolide-8-O-(5-hydroxyangelate)|9alpha-<2-methylbutyryloxy>-4beta,15-epoxyrepandanolide-8-O-<5-hydroxyangelate>
(3R,5R)-3,5-Dihydroxy-1-(4-hydroxy-3-methoxyphenyl)-7-(4-hydroxyphenyl)heptane 3-O-??-D-glucopyranoside
8R,8R-(-)-secoisolariciresinol-4-O-alpha-L-rhamnoside|secoisolariciresinol-4-O-alpha-L-rhamnoside
michaolide I
A cembrane diterpenoid with cytotoxic activity isolated from the soft coral Lobophytum michaelae.
2beta-O-beta-D-glucopyranosyl-6-deoxy-solidagolactone IV-18,19-olide
(-)-4-deacetyljunceellolide D|4-deacetyljunceellolide D
(12S)-1beta,6alpha,19-triacetoxy-12-hydroxy-4,18-epoxyneoclerod-13(14)-en-15,16-olide|ajugalide B|ajugalide-B|ajugamarin C1
(E)-2,3-dihydro-4-hydroxy-2-(1-hydroxy-1-methylethyl)-7,8-dimethoxy-6-(3,7-dimethyl-2,6-octadienyl)-5H-furo[3,2-b]xanthen-5-one|oliverixanthone
C26H36O10_2-Butenoic acid, 2-methyl-, (3R,3aS,4R,6R,8S,9bR)-6-(acetyloxy)-2,3,3a,4,5,6,6a,7,8,9b-decahydro-3,3a-dihydroxy-3,6,9-trimethyl-2-oxo-4-(1-oxobutoxy)azuleno[4,5-b]furan-8-yl ester, (2E)
[(3R,3aS,4R,6R,8S,9bR)-6-acetyloxy-4-butanoyloxy-3,3a-dihydroxy-3,6,9-trimethyl-2-oxo-4,5,6a,7,8,9b-hexahydroazuleno[4,5-b]furan-8-yl] (E)-2-methylbut-2-enoate_major
[(3R,3aS,4R,6R,8S,9bR)-6-acetyloxy-4-butanoyloxy-3,3a-dihydroxy-3,6,9-trimethyl-2-oxo-4,5,6a,7,8,9b-hexahydroazuleno[4,5-b]furan-8-yl] (E)-2-methylbut-2-enoate_0.8\\%
Gly Asn Arg Tyr
C21H32N8O7 (508.23938419999996)
Gly Asn Tyr Arg
C21H32N8O7 (508.23938419999996)
Gly Arg Asn Tyr
C21H32N8O7 (508.23938419999996)
Gly Arg Tyr Asn
C21H32N8O7 (508.23938419999996)
Gly Tyr Asn Arg
C21H32N8O7 (508.23938419999996)
Gly Tyr Arg Asn
C21H32N8O7 (508.23938419999996)
His Pro Gln Gln
C21H32N8O7 (508.23938419999996)
His Gln Pro Gln
C21H32N8O7 (508.23938419999996)
His Gln Gln Pro
C21H32N8O7 (508.23938419999996)
Met Pro Val Tyr
Met Pro Tyr Val
Met Val Pro Tyr
Met Val Tyr Pro
Met Tyr Pro Val
Met Tyr Val Pro
Asn Gly Arg Tyr
C21H32N8O7 (508.23938419999996)
Asn Gly Tyr Arg
C21H32N8O7 (508.23938419999996)
Asn Arg Gly Tyr
C21H32N8O7 (508.23938419999996)
Asn Arg Tyr Gly
C21H32N8O7 (508.23938419999996)
Asn Tyr Gly Arg
C21H32N8O7 (508.23938419999996)
Asn Tyr Arg Gly
C21H32N8O7 (508.23938419999996)
Pro His Gln Gln
C21H32N8O7 (508.23938419999996)
Pro Met Val Tyr
Pro Met Tyr Val
Pro Gln His Gln
C21H32N8O7 (508.23938419999996)
Pro Gln Gln His
C21H32N8O7 (508.23938419999996)
Pro Val Met Tyr
Pro Val Tyr Met
Pro Tyr Met Val
Pro Tyr Val Met
Gln His Pro Gln
C21H32N8O7 (508.23938419999996)
Gln His Gln Pro
C21H32N8O7 (508.23938419999996)
Gln Pro His Gln
C21H32N8O7 (508.23938419999996)
Gln Pro Gln His
C21H32N8O7 (508.23938419999996)
Gln Gln His Pro
C21H32N8O7 (508.23938419999996)
Gln Gln Pro His
C21H32N8O7 (508.23938419999996)
Arg Gly Asn Tyr
C21H32N8O7 (508.23938419999996)
Arg Gly Tyr Asn
C21H32N8O7 (508.23938419999996)
Arg Asn Gly Tyr
C21H32N8O7 (508.23938419999996)
Arg Asn Tyr Gly
C21H32N8O7 (508.23938419999996)
Arg Tyr Gly Asn
C21H32N8O7 (508.23938419999996)
Arg Tyr Asn Gly
C21H32N8O7 (508.23938419999996)
Val Met Pro Tyr
Val Met Tyr Pro
Val Pro Met Tyr
Val Pro Tyr Met
Val Tyr Met Pro
Val Tyr Pro Met
Tyr Gly Asn Arg
C21H32N8O7 (508.23938419999996)
Tyr Gly Arg Asn
C21H32N8O7 (508.23938419999996)
Tyr Met Pro Val
Tyr Met Val Pro
Tyr Asn Gly Arg
C21H32N8O7 (508.23938419999996)
Tyr Asn Arg Gly
C21H32N8O7 (508.23938419999996)
Tyr Pro Met Val
Tyr Pro Val Met
Tyr Arg Gly Asn
C21H32N8O7 (508.23938419999996)
Tyr Arg Asn Gly
C21H32N8O7 (508.23938419999996)
Tyr Val Met Pro
Tyr Val Pro Met
Acetyl T-2
D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins
Mozambioside
Cafamarine
Gibberellin A37 glucosyl ester
Shikokianin B
Argatroban Impurity 26
C23H36N6O5S (508.24677660000003)
Clocortolone Caproate
C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone C308 - Immunotherapeutic Agent > C574 - Immunosuppressant > C211 - Therapeutic Corticosteroid
3-Acetyl T-2 toxin
D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins
5-[(2E)-2-[7a-methyl-1-[(E)-7,7,7-trifluoro-6-hydroxy-6-(trifluoromethyl)hept-4-en-2-yl]-3a,5,6,7-tetrahydro-3H-inden-4-ylidene]ethylidene]cyclohexane-1,3-diol
C26H34F6O3 (508.24120059999996)
20-Benzyl-25-chloro-1,4,14,18,21,23-hexazatricyclo[20.3.1.06,11]hexacosa-6,8,10,22,24-pentaene-3,26-dione
(6S)-1-[4-(dimethylamino)-3-methylbenzyl]-5-(diphenylacetyl)-4,5,6,7-tetrahydro-1H-imidazo[4,5-c]pyridine-6-carboxylic acid
C31H32N4O3 (508.24742819999994)
D057911 - Angiotensin Receptor Antagonists > D057912 - Angiotensin II Type 2 Receptor Blockers D002317 - Cardiovascular Agents > D014662 - Vasoconstrictor Agents
1-[(4R,7S,8S)-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-[4-(trifluoromethyl)phenyl]urea
N-[(3R,3R,4S,5R)-5-(2-hydroxyethyl)-4-[(4-methoxyphenyl)-dimethylsilyl]-3-methyl-2-oxo-1-prop-2-enyl-5-spiro[indole-3,2-oxolane]yl]acetamide
1-[(4S,7R,8R)-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-[4-(trifluoromethyl)phenyl]urea
1-[(4S,7R,8S)-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-[4-(trifluoromethyl)phenyl]urea
1-[(4S,7S,8S)-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-[4-(trifluoromethyl)phenyl]urea
N-[[(2R,3S)-9-(dimethylamino)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl]-N,3,5-trimethyl-4-isoxazolesulfonamide
N-[[(2S,3S)-9-(dimethylamino)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl]-N,3,5-trimethyl-4-isoxazolesulfonamide
N-[[(2R,3R)-9-(dimethylamino)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl]-N,3,5-trimethyl-4-isoxazolesulfonamide
1-[(2S,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-[4-(trifluoromethyl)phenyl]urea
1-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-[4-(trifluoromethyl)phenyl]urea
1-[(4R,7R,8R)-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-[4-(trifluoromethyl)phenyl]urea
(1S)-1-[(3-fluorophenyl)-oxomethyl]-1-(hydroxymethyl)-7-methoxy-N-propyl-2-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4-piperidine]carboxamide
(1S)-2-[(4-fluorophenyl)-oxomethyl]-1-(hydroxymethyl)-7-methoxy-N-propan-2-yl-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4-piperidine]carboxamide
(1R)-N-(4-fluorophenyl)-1-(hydroxymethyl)-7-methoxy-1-(4-oxanylmethyl)-2-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3-azetidine]carboxamide
(1R)-N-(3-fluorophenyl)-1-(hydroxymethyl)-7-methoxy-1-(4-oxanylmethyl)-2-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,3-azetidine]carboxamide
N-[[(2S,3R)-9-(dimethylamino)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-2-yl]methyl]-N,3,5-trimethyl-4-isoxazolesulfonamide
1-[(2R,3R)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-[4-(trifluoromethyl)phenyl]urea
1-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-[4-(trifluoromethyl)phenyl]urea
1-[(2S,3S)-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-[4-(trifluoromethyl)phenyl]urea
1-[(2R,3R)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-(methylaminomethyl)-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-[4-(trifluoromethyl)phenyl]urea
1-[(4S,7S,8R)-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-[4-(trifluoromethyl)phenyl]urea
(1R)-1-[(3-fluorophenyl)-oxomethyl]-1-(hydroxymethyl)-7-methoxy-N-propyl-2-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4-piperidine]carboxamide
(1R)-2-[(4-fluorophenyl)-oxomethyl]-1-(hydroxymethyl)-7-methoxy-N-propan-2-yl-1-spiro[3,9-dihydro-1H-pyrido[3,4-b]indole-4,4-piperidine]carboxamide
2-(2,4-dihydroxyphenyl)-5,7-dihydroxy-3-(8-hydroxy-3,7-dimethylocta-2,6-dien-1-yl)-6-(3-methylbut-2-en-1-yl)-3,4-dihydro-2H-1-benzopyran-4-one
(1S,12R,14S,16S,17R)-14,17-dihydroxy-12-methyl-17-[[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxymethyl]-8-oxapentacyclo[14.2.1.01,13.04,12.05,9]nonadeca-5(9),6-dien-10-one
Acetyl-T2 Toxin
D009676 - Noxae > D011042 - Poisons > D014255 - Trichothecenes D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins
1-[[4-(Dimethylamino)-3-methylphenyl]methyl]-5-(2,2-diphenylacetyl)-6,7-dihydro-4H-imidazo[4,5-c]pyridine-6-carboxylic acid
C31H32N4O3 (508.24742819999994)
D057911 - Angiotensin Receptor Antagonists > D057912 - Angiotensin II Type 2 Receptor Blockers D002317 - Cardiovascular Agents > D014662 - Vasoconstrictor Agents
5,7-bis(acetyloxy)-2-hydroxy-4,8,12,17-tetramethyl-16-oxo-15,18-dioxatetracyclo[12.4.0.0¹,¹⁷.0³,⁸]octadec-12-en-9-yl acetate
5-(acetyloxy)-1-(furan-3-yl)-3b,6,6,9a,11a-pentamethyl-2,7-dioxo-1h,4h,5h,5ah,9bh,10h,11h-cyclopenta[a]phenanthren-4-yl acetate
(1r,3br,4s,5r,5ar,9as,9br,11as)-4-(acetyloxy)-1-(furan-3-yl)-3b,6,6,9a,11a-pentamethyl-2,7-dioxo-1h,4h,5h,5ah,9bh,10h,11h-cyclopenta[a]phenanthren-5-yl acetate
{3-hydroxy-4-[(2s)-2-hydroxy-6-methylheptan-2-yl]phenyl}methyl 2-hydroxy-4-(3-hydroxy-5-methylphenoxy)-6-methylbenzoate
(1r,2s)-2-{[(2s,3s)-2-hydroxy-2-methyl-3-[(3-methylbutanoyl)oxy]butanoyl]oxy}-1-(7-methoxy-2h-1,3-benzodioxol-5-yl)propyl 3-methylbut-2-enoate
1-hydroxy-4-(hydroxymethyl)-8,8,11a-trimethyl-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,6h,7h,7ah,9h,10h,11h-phenanthro[3,4-c]furan-3-one
2-{[5-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-7-(4-hydroxyphenyl)heptan-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
(2r,3'r,4'ar,5's,6'r,6'ar,10'ar,10'br)-5',6'-bis(acetyloxy)-4'a,10'b-dimethyl-5''-oxo-octahydrodispiro[oxirane-2,7'-naphtho[2,1-b]pyran-3',3''-oxolan]-6'a-ylmethyl acetate
(2r,3r,4s,5s,6r)-2-{[(3r,5r)-5-hydroxy-1-(4-hydroxy-3-methoxyphenyl)-7-(4-hydroxyphenyl)heptan-3-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
(1s,2s,7r,8r,9s,10s,12s,13s,16r)-8,10-bis(acetyloxy)-4,12,13-trihydroxy-5,9-dimethyl-2-(prop-1-en-2-yl)-15-oxatetracyclo[7.6.1.0²,⁶.0¹³,¹⁶]hexadec-4-en-7-yl acetate
(1r,2r,3s,4r,5s,7s,8s,9s,12z,14s,17r)-5,7-bis(acetyloxy)-2-hydroxy-4,8,12,17-tetramethyl-16-oxo-15,18-dioxatetracyclo[12.4.0.0¹,¹⁷.0³,⁸]octadec-12-en-9-yl acetate
2-[3,4-dihydroxy-2,6-bis(3-methylbut-2-en-1-yl)phenyl]-3,5,7-trihydroxy-8-(3-methylbut-2-en-1-yl)-2,3-dihydro-1-benzopyran-4-one
5',6'-bis(acetyloxy)-4'a,10'b-dimethyl-5''-oxo-octahydrodispiro[oxirane-2,7'-naphtho[2,1-b]pyran-3',3''-oxolan]-6'a-ylmethyl acetate
(1s,2s,3s,4r,5r,6s)-2,5-dihydroxy-3,4,6-tris({[(2z)-2-methylbut-2-enoyl]oxy})cyclohexyl (2z)-2-methylbut-2-enoate
[12,14-bis(acetyloxy)-2,3-dihydroxy-4,13,17-trimethyl-5-oxo-6-oxatricyclo[11.4.0.0³,⁷]heptadeca-8,16-dien-9-yl]methyl acetate
2-[8-(acetyloxy)-8a-[(acetyloxy)methyl]-4-hydroxy-5,6-dimethyl-hexahydro-2h-spiro[naphthalene-1,2'-oxiran]-5-yl]-1-(5-oxo-2h-furan-3-yl)ethyl acetate
(1r,2s)-2-({2-hydroxy-2-methyl-3-[(3-methylbutanoyl)oxy]butanoyl}oxy)-1-(7-methoxy-2h-1,3-benzodioxol-5-yl)propyl 3-methylbut-2-enoate
(1r,2s,3s,4r,5r,6s)-2,4-dihydroxy-3,5,6-tris({[(2z)-2-methylbut-2-enoyl]oxy})cyclohexyl (2z)-2-methylbut-2-enoate
[(1s,2r,3r,4r,7s,8e,12s,13s,14s)-12,14-bis(acetyloxy)-2,3-dihydroxy-4,13,17-trimethyl-5-oxo-6-oxatricyclo[11.4.0.0³,⁷]heptadeca-8,16-dien-9-yl]methyl acetate
4-[2-(7,8-dimethyl-3-oxo-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,5h,6h,6ah,8h,9h,10h-naphtho[4,4a-c]furan-7-yl)ethyl]-5h-furan-2-one
(1s,2r,3s,4r,5r,7s,8s,9r,12z,14s,17r)-7,9-bis(acetyloxy)-5-hydroxy-4,8,12,17-tetramethyl-16-oxo-15,18-dioxatetracyclo[12.4.0.0¹,¹⁷.0³,⁸]octadec-12-en-2-yl acetate
(1s,2s,3r,4r,5r,6s)-3,5-dihydroxy-2,4,6-tris({[(2z)-2-methylbut-2-enoyl]oxy})cyclohexyl (2z)-2-methylbut-2-enoate
1-[8-(acetyloxy)-8a-[(acetyloxy)methyl]-6-hydroxy-5,6-dimethyl-hexahydrospiro[naphthalene-1,2'-oxiran]-5-yl]-2-(5-oxo-2h-furan-3-yl)ethyl acetate
2-({2-hydroxy-2-methyl-3-[(3-methylbutanoyl)oxy]butanoyl}oxy)-1-(7-methoxy-2h-1,3-benzodioxol-5-yl)propyl 3-methylbut-2-enoate
[(5ar,7ar,8r,9s,11as,11br)-9-(acetyloxy)-5a,8,11a-trimethyl-1-oxo-3-phenyl-6,7,7a,9,10,11,11b,12-octahydro-2,5-dioxatetraphen-8-yl]methyl acetate
(1s,2r,3s,4s,5r,6r)-2,5-dihydroxy-3,4,6-tris({[(2z)-2-methylbut-2-enoyl]oxy})cyclohexyl (2z)-2-methylbut-2-enoate
(2s)-2-[(2s)-2-[(1-hydroxyethylidene)amino]-n-methyl-3-phenylpropanamido]-n-[(1z)-2-(1h-indol-3-yl)ethenyl]-3-phenylpropanimidic acid
C31H32N4O3 (508.24742819999994)
(3r,5r)-3,5-dihydroxy-1-(4-hydroxy-3-me-thoxyphenyl)-7-(4-hydroxyphenyl)heptane3-o-β-d-glucopyranoside
{"Ingredient_id": "HBIN009544","Ingredient_name": "(3r,5r)-3,5-dihydroxy-1-(4-hydroxy-3-me-thoxyphenyl)-7-(4-hydroxyphenyl)heptane3-o-\u03b2-d-glucopyranoside","Alias": "NA","Ingredient_formula": "C26H36O10","Ingredient_Smile": "COC1=C(C=CC(=C1)CCC(CC(CCC2=CC=C(C=C2)O)O)OC3C(C(C(C(O3)CO)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5912","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
ajugalide a
{"Ingredient_id": "HBIN014969","Ingredient_name": "ajugalide a","Alias": "NA","Ingredient_formula": "C26H36O10","Ingredient_Smile": "CC1CC(C2(C(C1(C)CC(C3=CC(=O)OC3)OC(=O)C)C(CCC24CO4)O)COC(=O)C)OC(=O)C","Ingredient_weight": "508.6 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "795","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "12136677","DrugBank_id": "NA"}
anhydrohirundigenin monothevetoside
C30H29FN6O (508.23867559999997)
{"Ingredient_id": "HBIN016162","Ingredient_name": "anhydrohirundigenin monothevetoside","Alias": "NA","Ingredient_formula": "C30H29FN6O","Ingredient_Smile": "CCNCC(=CC(=CC)C1=NC2=C(C=C1)NNC2=C3C=C4C(=N3)C=CN=C4C5=CC(=CC(=C5)F)OC)C=C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1272","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
(1s,2s,3s,4r,5s,6s)-2,4-dihydroxy-3,5,6-tris[(2-methylbut-2-enoyl)oxy]cyclohexyl (2z)-2-methylbut-2-enoate
(5s,12r)-5-{2-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-3,4-dihydroxyphenyl}-9,12-dihydroxy-13,13-dimethyl-4,14-dioxatricyclo[8.4.0.0³,⁸]tetradeca-1,3(8),9-trien-7-one
(2r,3r)-2-{3-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-2,4-dihydroxyphenyl}-3,5,7-trihydroxy-6-(3-methylbut-2-en-1-yl)-2,3-dihydro-1-benzopyran-4-one
methyl (3as,4s,5s,11ar)-4-{[(2s,3s)-2,3-dihydroxy-2-methylbutanoyl]oxy}-10-methyl-5-{[(2r)-2-methylbutanoyl]oxy}-3-methylidene-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-6-carboxylate
(1s,7as,11as)-5-hydroxy-4-(hydroxymethyl)-8,8,11a-trimethyl-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,6h,7h,7ah,9h,10h,11h-phenanthro[3,4-c]furan-3-one
(1'r,2s,2'r,3'r,4's,7'r,8'z,12'r,13'r,14'r)-2',14'-bis(acetyloxy)-3'-hydroxy-4',9',13'-trimethyl-5'-oxo-6'-oxaspiro[oxirane-2,17'-tricyclo[11.4.0.0³,⁷]heptadecan]-8'-en-12'-yl acetate
3-[2-(7,8-dimethyl-3-oxo-5-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,5h,6h,6ah,8h,9h,10h-naphtho[4,4a-c]furan-7-yl)ethyl]-5h-furan-2-one
(1s,2s,3r,4r,7s,8z,10r,12s,13r,14s)-2,14-bis(acetyloxy)-3,10-dihydroxy-4,9,13-trimethyl-17-methylidene-5-oxo-6-oxatricyclo[11.4.0.0³,⁷]heptadec-8-en-12-yl acetate
(1r,2s,3s,4s,5r,6s)-2,4-dihydroxy-3,6-bis[(2-methylbut-2-enoyl)oxy]-5-{[(2z)-2-methylbut-2-enoyl]oxy}cyclohexyl 2-methylbut-2-enoate
(1s,11as)-5-hydroxy-4-(hydroxymethyl)-8,8,11a-trimethyl-1-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,6h,7h,7ah,9h,10h,11h-phenanthro[3,4-c]furan-3-one
(3as,6s,8s,9r,9as,9bs)-6,9-dihydroxy-6,9-dimethyl-3-methylidene-2-oxo-3ah,4h,5h,8h,9ah,9bh-azuleno[4,5-b]furan-8-yl 2-[(2r,4as,8ar)-4a-methyl-8-methylidene-7-oxo-2,3,4,8a-tetrahydro-1h-naphthalen-2-yl]prop-2-enoate
(2s)-2-[2-(3,7-dimethylocta-2,6-dien-1-yl)-3,4-dihydroxyphenyl]-5,7-dihydroxy-6-(2-hydroxy-3-methylbut-3-en-1-yl)-2,3-dihydro-1-benzopyran-4-one
2-({2-hydroxy-2-methyl-3-[(2-methylbutanoyl)oxy]butanoyl}oxy)-1-(7-methoxy-2h-1,3-benzodioxol-5-yl)propyl 2-methylbut-2-enoate
(3s,3ar,4s,6ar,8s,9ar,9br)-3-methyl-6,9-dimethylidene-2-oxo-4-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-octahydro-3h-azuleno[4,5-b]furan-8-yl (2z)-2-methylbut-2-enoate
(3r)-2-[3,4-dihydroxy-2,6-bis(3-methylbut-2-en-1-yl)phenyl]-3,5,7-trihydroxy-8-(3-methylbut-2-en-1-yl)-2,3-dihydro-1-benzopyran-4-one
4,10-bis(acetyloxy)-6,8-dihydroxy-3a-(2-hydroxypropan-2-yl)-1,8a-dimethyl-5-methylidene-2-oxo-3h,4h,4ah,6h,7h,8h,9h,10h-cyclohexa[f]azulen-9-yl acetate
12',14'-bis(acetyloxy)-3'-hydroxy-4',9',13'-trimethyl-5'-oxo-6'-oxaspiro[oxirane-2,17'-tricyclo[11.4.0.0³,⁷]heptadecan]-8'-en-2'-yl acetate
[(1s,2r,3r,4r,7s,8e,12r,13s,14s)-12,14-bis(acetyloxy)-2,3-dihydroxy-4,13,17-trimethyl-5-oxo-6-oxatricyclo[11.4.0.0³,⁷]heptadeca-8,16-dien-9-yl]methyl acetate
(1r,2r)-2-(acetyloxy)-1-[(1r,4r,6r,7s,10s,14r)-14-(acetyloxy)-7-hydroxy-7-methyl-2-methylidene-5,13-dioxatricyclo[8.4.0.0⁴,⁶]tetradec-11-en-11-yl]-2-[(2r)-3,3-dimethyloxiran-2-yl]ethyl acetate
methyl 4-[(2,3-dihydroxy-2-methylbutanoyl)oxy]-10-methyl-5-[(2-methylbutanoyl)oxy]-3-methylidene-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-6-carboxylate
(1r,2r,3s,4r,5s,7s,8r,9r,12z,14s,17r)-5,7-bis(acetyloxy)-2-hydroxy-4,8,12,17-tetramethyl-16-oxo-15,18-dioxatetracyclo[12.4.0.0¹,¹⁷.0³,⁸]octadec-12-en-9-yl acetate
(1s,11as)-1-hydroxy-4-(hydroxymethyl)-8,8,11a-trimethyl-5-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,6h,7h,7ah,9h,10h,11h-phenanthro[3,4-c]furan-3-one
7,9-bis(acetyloxy)-5-hydroxy-4,8,12,17-tetramethyl-16-oxo-15,18-dioxatetracyclo[12.4.0.0¹,¹⁷.0³,⁸]octadec-12-en-2-yl acetate
(1r,2s,3s,4r,5r,6r)-2,5-dihydroxy-3,4,6-tris({[(2z)-2-methylbut-2-enoyl]oxy})cyclohexyl (2z)-2-methylbut-2-enoate
(1s,2s,3r,4r,5r,6r)-2,5-dihydroxy-3,4,6-tris[(2-methylbut-2-enoyl)oxy]cyclohexyl (2z)-2-methylbut-2-enoate
(2s)-2-{2-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-3,4-dihydroxyphenyl}-5,7-dihydroxy-6-[(2s)-2-hydroxy-3-methylbut-3-en-1-yl]-2,3-dihydro-1-benzopyran-4-one
6-[(2e)-3,7-dimethylocta-2,6-dien-1-yl]-4-hydroxy-2-(2-hydroxypropan-2-yl)-7,8-dimethoxy-2h,3h-furo[3,2-b]xanthen-5-one
[9-(acetyloxy)-5a,8,11a-trimethyl-1-oxo-3-phenyl-6,7,7a,9,10,11,11b,12-octahydro-2,5-dioxatetraphen-8-yl]methyl acetate
(1s,2s,3s,4r,7s,8z,10r,12s,13r,14s)-2,14-bis(acetyloxy)-3,10-dihydroxy-4,9,13-trimethyl-17-methylidene-5-oxo-6-oxatricyclo[11.4.0.0³,⁷]heptadec-8-en-12-yl acetate
(1r,2r,3s,4r,5s,7s,8s,9r,12z,14s,17r)-5,7-bis(acetyloxy)-2-hydroxy-4,8,12,17-tetramethyl-16-oxo-15,18-dioxatetracyclo[12.4.0.0¹,¹⁷.0³,⁸]octadec-12-en-9-yl acetate
3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl (4e)-5-{7-hydroxy-4,9-dimethyl-11-oxo-10-oxatricyclo[6.3.2.0¹,⁷]tridec-3-en-9-yl}-2-methylpenta-2,4-dienoate
(1's,2r,2's,3's,4'r,7's,12's,13's,14's)-12',14'-bis(acetyloxy)-3'-hydroxy-4',9',13'-trimethyl-5'-oxo-6'-oxaspiro[oxirane-2,17'-tricyclo[11.4.0.0³,⁷]heptadecan]-8'-en-2'-yl acetate
(3as,4s,4ar,6s,8s,8as,9r,10r)-9,10-bis(acetyloxy)-6,8-dihydroxy-3a-(2-hydroxypropan-2-yl)-1,8a-dimethyl-5-methylidene-2-oxo-3h,4h,4ah,6h,7h,8h,9h,10h-cyclohexa[f]azulen-4-yl acetate
(1's,2r,2's,3's,4'r,7's,8'z,12's,13's,14's)-12',14'-bis(acetyloxy)-3'-hydroxy-4',9',13'-trimethyl-5'-oxo-6'-oxaspiro[oxirane-2,17'-tricyclo[11.4.0.0³,⁷]heptadecan]-8'-en-2'-yl acetate
(1r,2r,3s,4r,5s,6s)-2,6-dihydroxy-3,4,5-tris({[(2z)-2-methylbut-2-enoyl]oxy})cyclohexyl (2z)-2-methylbut-2-enoate
(2r,3r)-2-[3,4-dihydroxy-2,6-bis(3-methylbut-2-en-1-yl)phenyl]-3,5,7-trihydroxy-8-(3-methylbut-2-en-1-yl)-2,3-dihydro-1-benzopyran-4-one
(1s,2s,3r,4r,5s,6r)-2,5-dihydroxy-3,4,6-tris[(2-methylbut-2-enoyl)oxy]cyclohexyl (2z)-2-methylbut-2-enoate
[3-hydroxy-4-(2-hydroxy-6-methylheptan-2-yl)phenyl]methyl 2-hydroxy-4-(3-hydroxy-5-methylphenoxy)-6-methylbenzoate
4,8-bis(acetyloxy)-5-[2-hydroxy-2-(5-oxo-2h-furan-3-yl)ethyl]-5,6-dimethyl-hexahydro-2h-spiro[naphthalene-1,2'-oxiran]-8a-ylmethyl acetate
(1's,2r,2'r,3's,4'r,7's,8'z,12'r,13's,14's)-12',14'-bis(acetyloxy)-3'-hydroxy-4',9',13'-trimethyl-5'-oxo-6'-oxaspiro[oxirane-2,17'-tricyclo[11.4.0.0³,⁷]heptadecan]-8'-en-2'-yl acetate
(2's,3's,4r)-2,2''-diimino-2'-(1h-indol-3-yl)-1,1'',3,3''-tetramethyl-4',9'-dihydro-2'h-dispiro[imidazolidine-4,1'-carbazole-3',4''-imidazolidine]-5,5''-dione
[(5ar,7as,8r,9r,11ar,11bs)-9-(acetyloxy)-5a,8,11a-trimethyl-1-oxo-3-phenyl-6,7,7a,9,10,11,11b,12-octahydro-2,5-dioxatetraphen-8-yl]methyl acetate
(1s)-2-[(1r,4r,4ar,5s,6r,8s,8ar)-8-(acetyloxy)-8a-[(acetyloxy)methyl]-4-hydroxy-5,6-dimethyl-hexahydro-2h-spiro[naphthalene-1,2'-oxiran]-5-yl]-1-(5-oxo-2h-furan-3-yl)ethyl acetate
2-[2-(3,7-dimethylocta-2,6-dien-1-yl)-3,4-dihydroxyphenyl]-5,7-dihydroxy-6-(2-hydroxy-3-methylbut-3-en-1-yl)-2,3-dihydro-1-benzopyran-4-one
2,7,12,13'-tetramethyl-4',5,10,14',16'-pentaoxaspiro[pentacyclo[10.2.2.0¹,¹¹.0⁴,⁸.0⁹,¹¹]hexadecane-14,6'-tetracyclo[11.2.1.0¹,¹⁰.0³,⁷]hexadecane]-9',15-diene-5',6-dione
(1r,3br,4s,5r,5ar,9br,11as)-4-(acetyloxy)-1-(furan-3-yl)-3b,6,6,9a,11a-pentamethyl-2,7-dioxo-1h,4h,5h,5ah,9bh,10h,11h-cyclopenta[a]phenanthren-5-yl acetate
2,27-dihydroxy-6,10,15,20,20-pentamethyl-8,12,21-trioxaheptacyclo[13.13.0.0²,¹¹.0⁴,⁹.0¹¹,¹³.0¹⁶,²⁷.0¹⁹,²⁵]octacosa-3,5,23,25-tetraene-7,22-dione
2,4-dihydroxy-3,5,6-tris[(2-methylbut-2-enoyl)oxy]cyclohexyl 2-methylbut-2-enoate
3-methyl-6,9-dimethylidene-2-oxo-4-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-octahydro-3h-azuleno[4,5-b]furan-8-yl 2-methylbut-2-enoate
(2s)-5,7-dihydroxy-8-[(2s)-5-methyl-2-(prop-1-en-2-yl)hex-4-en-1-yl]-6-(3-methylbut-2-en-1-yl)-2-(2,4,6-trihydroxyphenyl)-2,3-dihydro-1-benzopyran-4-one
(1s,7as,11as)-1,5-dihydroxy-8,8,11a-trimethyl-4-({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-1h,6h,7h,7ah,9h,10h,11h-phenanthro[3,4-c]furan-3-one
5-[2-(3,7-dimethylocta-2,6-dien-1-yl)-3,4-dihydroxyphenyl]-9,12-dihydroxy-13,13-dimethyl-4,14-dioxatricyclo[8.4.0.0³,⁸]tetradeca-1,3(8),9-trien-7-one
(2s)-2-[(2s)-2-[(1-hydroxyethylidene)amino]-n-methyl-3-phenylpropanamido]-n-[(1e)-2-(1h-indol-3-yl)ethenyl]-3-phenylpropanimidic acid
C31H32N4O3 (508.24742819999994)