Exact Mass: 462.1791938
Exact Mass Matches: 462.1791938
Found 290 metabolites which its exact mass value is equals to given mass value 462.1791938
,
within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error
0.001 dalton.
Verbasoside
Verbasoside is found in root vegetables. Verbasoside is isolated from Stachys sieboldii (Chinese artichoke). Isolated from Stachys sieboldii (Chinese artichoke). Verbasoside is found in root vegetables.
13-Hydroxy-5'-O-methylmelledonal
13-Hydroxy-5-O-methylmelledonal is found in mushrooms. 13-Hydroxy-5-O-methylmelledonal is a metabolite of Armillaria mellea (honey mushroom Metabolite of Armillaria mellea (honey mushroom). 13-Hydroxy-5-O-methylmelledonal is found in mushrooms.
Retrocalamin
Retrocalamin is found in citrus. Retrocalamin is a constituent of calamondin seeds (Citrus reticulata). Constituent of calamondin seeds (Citrus reticulata). Retrocalamin is found in citrus.
6-O-Methylarmillaridin
6-O-Methylarmillaridin is found in mushrooms. 6-O-Methylarmillaridin is a metabolite of Armillaria mellea (honey mushroom Metabolite of Armillaria mellea (honey mushroom). 6-O-Methylarmillaridin is found in mushrooms.
4-O-Carboxymethyl ascochlorin
N-(3-(4-Methylpiperazin-1-yl)phenyl)-8-(4-(methylsulfonyl)phenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
ForsythosideE
Forsythoside E is a natural product found in Forsythia suspensa and Firmiana simplex with data available. Forsythoside E is a phenylethanoid glycoside isolated from the fruits of forsythia suspense (thunb.) vahl[1]. Forsythoside E is a phenylethanoid glycoside isolated from the fruits of forsythia suspense (thunb.) vahl[1].
eupalinolide A
Eupalinolide A, isolated from Eupatorium lindleyanum, induces the expression of HSP70 via the activation of HSF1 by inhibiting the interaction between HSF1 and HSP90[1]. Eupalinolide A, isolated from Eupatorium lindleyanum, induces the expression of HSP70 via the activation of HSF1 by inhibiting the interaction between HSF1 and HSP90[1]. Eupalinolide B is a germacrane sesquiterpene isolated from Eupatorium lindleyanum. Eupalinolide B demonstrates potent cytotoxicity against A-549, BGC-823 and HL-60 tumour cell lines[1]. Eupalinolide B is a germacrane sesquiterpene isolated from Eupatorium lindleyanum. Eupalinolide B demonstrates potent cytotoxicity against A-549, BGC-823 and HL-60 tumour cell lines[1].
Eupalinolide
Eupalinolide A, isolated from Eupatorium lindleyanum, induces the expression of HSP70 via the activation of HSF1 by inhibiting the interaction between HSF1 and HSP90[1]. Eupalinolide A, isolated from Eupatorium lindleyanum, induces the expression of HSP70 via the activation of HSF1 by inhibiting the interaction between HSF1 and HSP90[1]. Eupalinolide B is a germacrane sesquiterpene isolated from Eupatorium lindleyanum. Eupalinolide B demonstrates potent cytotoxicity against A-549, BGC-823 and HL-60 tumour cell lines[1]. Eupalinolide B is a germacrane sesquiterpene isolated from Eupatorium lindleyanum. Eupalinolide B demonstrates potent cytotoxicity against A-549, BGC-823 and HL-60 tumour cell lines[1].
Forsythoside
Forsythoside is a natural product found in Forsythia viridissima with data available. Forsythoside E is a phenylethanoid glycoside isolated from the fruits of forsythia suspense (thunb.) vahl[1]. Forsythoside E is a phenylethanoid glycoside isolated from the fruits of forsythia suspense (thunb.) vahl[1].
7-(3,4-dihydroxyphenyl)-1-(4-hydroxyphenyl)-5-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyheptan-3-one
3beta-hydroxy-8alpha-(2,3-diacetoxy-2-methylbutyryloxy)-eremanthin|3beta-hydroxy-8alpha-<2,3-diacetoxy-2-methylbutyryloxy>-eremanthin
(+)-arborone|3-hydroxymethyl-4-(3,4,5-trimethoxybenzoyl)-2-(3,4,5-trimethoxyphenyl)-2,3-cis-3,4-trans-tetrahydrofuran
N,N-Bis-(2-hydroxy-5-oxo-cyclopent-1-enyl)-hexadeca-2t,4t,6t,8t,10t,12t,14t-heptaendisaeure-diamid|N,N-bis-(2-hydroxy-5-oxo-cyclopent-1-enyl)-hexadeca-2t,4t,6t,8t,10t,12t,14t-heptaenedioic acid diamide
1-O-beta-D-glucopyranosyl-1S,4aS,5S,7aS-tetrahydro-5alpha-butoxy-7-(hydroxymethyl)-cyclopenta[c]pyran-4-carboxylic acid|rhodolatouside A
3,4-dimethoxyphenyl 1-O-alpha-L-rhamnopyranosyl-(1?6)-O-beta-D-glucopyranoside|3,4-dimethoxyphenyl-6-O-(alpha-L-rhamnopyranosyl)-beta-D-glucopyranoside
6-acetyl-10-hydroxy-teucjaponin B|6-acetyl-10-hydroxyteucjaponin B
(1S*,2R*,3R*,5Z,7S*,8R*,9S*,10S*,11R*,13Z,17R*)-2,3-diacetoxy-8,17-epoxy-9-hydroxybriara-5,13-diene-12,18-dione|excavatolide Q
2-(3,4-dihydroxyphenyl)ethyl 2-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-allopyranoside|2-(3,4-dihydroxyphenyl)ethyl O-alpha-L-rhamnopyranosyl-(1->2)-beta-D-allopyranoside|2-O-alpha-L-rhamnopyranosyl-beta-D-allopyranoside
(7S,8R)-3,3-didemethoxydihydrodehydrodiconiferyl alcohol 4-O-beta-D-glucopyranoside|isocupressoside B
salvicin B|[(2S,3R,4R)-4-hydroxy-4-(4-hydroxy-3-methoxybenzyl)-2-(4-hydroxy-3-methoxyphenyl)tetrahydro-3-furanyl]methyl 4-hydroxy-butanoate
(7R,8S)-8-methyl-9-oxo-7-(3,4,5-trimethoxyphenyl)butyl 3,4,5-trimethoxybenzoate|tsangin C
2-{1-[(2R,3S)-2,3-dihydro-3-hydroxymethyl-5-(3-hydroxypropyl)-7-methoxy-2-benzofuranyl]-3-methoxy-4-phenoxy}-3-hydroxypropanoic acid methyl ester|dunnianeolignan B
1-(3,4-Dihydroxyphenyl)-3,5-diacetoxy-7-(3,4-dihydroxy-5-methoxyphenyl)heptane
2-(4-hydroxyphenyl)-ethyl-O-beta-D-glucopyranosyl-6-O-beta-D-glucopyranoside
homovanillyl alcohol 4-O-beta-D-apiofuranosyl-(1?6)-beta-D-glucopyranoside|pteleifoside E
(5S)-1-(3,4-dihydroxyphenyl)-5-hydroxy-7-(4-hydroxyphenyl)-3-heptanone-5-O-beta-D-xylopyranoside|(5S)-1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)-5-(beta-D-xylopyranosyloxy)heptan-3-one|1-(3,4-dihydroxyphenyl)-7-(4-hydroxyphenyl)-3-heptanone-5-O-beta-D-xylopyranose|alnuside A|alnuside B
2-methoxy-4-hydroxymethylphenol 1-O-alpha-rhamnopyranosyl-(1->6)-beta-D-glucopyranoside
2alpha,13-diacetoxy-4-hydroxy-8alpha-tigloyloxybourbonen-12,6alpha-olide|2alpha,13-diacetoxy-4alpha-hydroxy-8alpha-tigloyloxybourbonen-12,6alpha-olide
1,1-Dibenzene-6,8,9-trihydroxy-3-allyl-4-O-??-D-glucopyranoside
3beta-acetoxy-8beta-(4-acetoxytigloyloxy)-14-hydroxycostunolide
magnolignan A 2-O-beta-D-glucopyranoside|magnolignan A-2-O-beta-D-glucopyranoside
2-hydroxy-5-(2-hydroxyethyl)phenol 1-O-alpha-rhamnopyranosyl-(1->6)-O-beta-glucopyranoside|calophymembranside B
3-deacetyl-20-epi-teulanigin|3-deacetyl-20-epieulanigin
Ser Asn Gln Asp
7-(3,4-dihydroxyphenyl)-1-(4-hydroxyphenyl)-5-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyheptan-3-one
C20H30O12_Hexopyranoside, 3,4-dimethoxyphenyl 6-O-(6-deoxy-alpha-L-mannopyranosyl)
(2S,3R,4R,5R,6S)-2-[(2R,3R,4S,5R,6R)-2-[2-(3,4-dihydroxyphenyl)ethoxy]-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-6-methyloxane-3,4,5-triol
(2S,3R,4R,5R,6S)-2-[(2R,3R,4S,5R,6R)-2-[2-(3,4-dihydroxyphenyl)ethoxy]-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl]oxy-6-methyloxane-3,4,5-triol_major
Asp Met Pro Thr
Asp Met Thr Pro
Asp Asn Asn Thr
Asp Asn Gln Ser
Asp Asn Ser Gln
Asp Asn Thr Asn
Asp Pro Met Thr
Asp Pro Thr Met
Asp Gln Asn Ser
Asp Gln Ser Asn
Asp Ser Asn Gln
Asp Ser Gln Asn
Asp Thr Met Pro
Asp Thr Asn Asn
Asp Thr Pro Met
Glu Met Pro Ser
Glu Met Ser Pro
Glu Asn Asn Ser
Glu Asn Ser Asn
Glu Pro Met Ser
Glu Pro Ser Met
Glu Ser Met Pro
Glu Ser Asn Asn
Glu Ser Pro Met
Gly His Ser Tyr
Gly His Tyr Ser
Gly Asn Ser Trp
Gly Asn Trp Ser
Gly Ser His Tyr
Gly Ser Asn Trp
Gly Ser Trp Asn
Gly Ser Tyr His
Gly Trp Asn Ser
Gly Trp Ser Asn
Gly Tyr His Ser
Gly Tyr Ser His
His Gly Ser Tyr
His Gly Tyr Ser
His Ser Gly Tyr
His Ser Tyr Gly
His Tyr Gly Ser
His Tyr Ser Gly
Met Asp Pro Thr
Met Asp Thr Pro
Met Glu Pro Ser
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Asn Asp Asn Thr
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Asn Asp Ser Gln
Asn Asp Thr Asn
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Asn Gly Ser Trp
Asn Gly Trp Ser
Asn Asn Asp Thr
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Asn Asn Ser Glu
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Asn Trp Ser Gly
Pro Asp Met Thr
Pro Asp Thr Met
Pro Glu Met Ser
Pro Glu Ser Met
Pro Met Asp Thr
Pro Met Glu Ser
Pro Met Ser Glu
Pro Met Thr Asp
Pro Ser Glu Met
Pro Ser Met Glu
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Gln Asp Asn Ser
Gln Asp Ser Asn
Gln Asn Asp Ser
Gln Asn Ser Asp
Gln Ser Asp Asn
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Ser Asp Asn Gln
Ser Asp Gln Asn
Ser Glu Met Pro
Ser Glu Asn Asn
Ser Glu Pro Met
Ser Gly His Tyr
Ser Gly Asn Trp
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Ser His Gly Tyr
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Ser Met Glu Pro
Ser Met Pro Glu
Ser Asn Asp Gln
Ser Asn Glu Asn
Ser Asn Gly Trp
Ser Asn Asn Glu
Ser Asn Trp Gly
Ser Pro Glu Met
Ser Pro Met Glu
Ser Gln Asp Asn
Ser Gln Asn Asp
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Ser Trp Asn Gly
Ser Tyr Gly His
Ser Tyr His Gly
Thr Asp Met Pro
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Thr Asp Pro Met
Thr Met Asp Pro
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Trp Gly Asn Ser
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Tyr Gly His Ser
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CAY10593
4-O-Methylarmillaridin
13-Hydroxy-5'-O-methylmelledonal
Retrocalamin
Verbasoside
Ethyl 16-hydroxy-18-bromo-8E,17E19Z-tricosatrien-4,6-diynoate
C25H35BrO3 (462.17694200000005)
1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-5-oxo-3-heptanyl ?-D-xylopyranoside
Ethyl 16-hydroxy-18-bromo-8E,17E19Z-tricosatrien-4,6-diynoate
Cariprazine HCl
D002492 - Central Nervous System Depressants > D014149 - Tranquilizing Agents > D014150 - Antipsychotic Agents D002491 - Central Nervous System Agents > D011619 - Psychotropic Drugs > D014149 - Tranquilizing Agents D002491 - Central Nervous System Agents > D002492 - Central Nervous System Depressants C78272 - Agent Affecting Nervous System > C29710 - Antipsychotic Agent Cariprazine hydrochloride is a novel antipsychotic agent candidate that exhibits high affinity for the D3 (Ki=0.085 nM) and D2 (Ki=0.49 nM) receptors, and moderate affinity for the 5-HT1A receptor (Ki=2.6 nM).
CEP-33779
Perospirone hydrochloride
Perospirone hydrochloride (SM-9018) is an orally active antagonist of 5-HT2A receptor (Ki of 0.6 nM) and dopamine D2 receptor (Ki of 1.4 nM). Perospirone hydrochloride is also a partial agonist of 5-HT1A receptor (Ki of 2.9 nM). Perospirone hydrochloride is an atypical antipsychotic agent and has the potential for schizophrenic disease research[1][2].
16alpha-hydroxy-17-oxoestra-1,3,5(10)-trien-3-yl beta-D-glucopyranosiduronic acid
2-[2-chloro-4-formyl-5-hydroxy-3-methyl-6-[(2E,4E)-3-methyl-5-(1,2,6-trimethyl-3-oxocyclohexyl)penta-2,4-dienyl]phenoxy]acetic acid
2-(4-Methoxyphenyl)acetic acid [2-[4-[(4-ethoxyanilino)-oxomethyl]anilino]-2-oxoethyl] ester
Asp-Met-Thr-Pro
A tetrapeptide composed of L-aspartic acid, L-methionine, L-threonine and L-proline joined in sequence by peptide linkages.
3-hydroxy-17-oxoestra-1,3,5(10)-trien-2-yl beta-D-glucopyranosiduronic acid
3-hydroxy-17-oxoestra-1,3,5(10)-trien-4-yl beta-D-glucopyranosiduronic acid
(2R,3R,3aS,9bS)-N-[(4-fluorophenyl)methyl]-3-(hydroxymethyl)-6-oxo-1-[oxo(3-pyridinyl)methyl]-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxamide
(2S,3S,3aR,9bR)-N-[(4-fluorophenyl)methyl]-3-(hydroxymethyl)-6-oxo-1-[oxo(3-pyridinyl)methyl]-3,3a,4,9b-tetrahydro-2H-pyrrolo[2,3-a]indolizine-2-carboxamide
4-hydroxy-17-oxoestra-1,3,5(10)-trien-3-yl beta-D-glucopyranosiduronic acid
2-hydroxy-17-oxoestra-1,3,5(10)-trien-3-yl beta-D-glucopyranosiduronic acid
abacavir 5-glucuronide
A glucosiduronic acid derivative formed by linkage of beta-D-glucosiduronic acid with the 5-oxygen of abacavir. One of the two major metabolites of abacavir in humans (the other is the 5-carboxylic acid, CHEBI:64192).
BI-3406
BI-3406 (compound I-6) is an orally active, highly potent and selective inhibitor of the interaction between KRAS and Son of Sevenless 1 (SOS1) with an IC50 of 6 nM. BI-3406 potently reduces the formation of GTP-loaded KRAS, and inhibits MAPK pathway signaling. BI-3406 has anticancer activity[1][2].
VU0155069
VU0155069 (CAY10593), is a selective phospholipase D1 (PLD1) inhibitor with an IC50 value of 46 nM in vitro. VU0155069 (CAY10593) strongly inhibits the invasive migration of several cancer cell lines in transwell assays[1][2].
7-hydroxy-4,7-bis(hydroxymethyl)-6-{[3-(4-hydroxyphenyl)prop-2-enoyl]oxy}-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-1-yl 3-methylbutanoate
2-[4-(hydroxymethyl)-2-methoxyphenoxy]-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxane-3,4,5-triol
(1s,4as,6s,7r,7as)-7-hydroxy-4,7-bis(hydroxymethyl)-6-{[(2z)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}-1h,4ah,5h,6h,7ah-cyclopenta[c]pyran-1-yl 3-methylbutanoate
8-(acetyloxy)-3-[(acetyloxy)methyl]-10-hydroxy-6,10-dimethyl-2-oxo-4h,5h,8h,9h-cyclodeca[b]furan-4-yl 2-methylbut-2-enoate
(3ar,4r,9s,11ar)-9-(acetyloxy)-6-(hydroxymethyl)-10-methyl-3-methylidene-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-4-yl (2e)-4-(acetyloxy)-2-methylbut-2-enoate
9-(acetyloxy)-6-(hydroxymethyl)-10-methyl-3-methylidene-2-oxo-3ah,4h,5h,8h,9h,11ah-cyclodeca[b]furan-4-yl 4-(acetyloxy)-2-methylbut-2-enoate
(2r,3r,4r,5r,6s)-2-{[(2r,3s,4s,5r,6r)-6-[2-(3,4-dihydroxyphenyl)ethoxy]-3,4,5-trihydroxyoxan-2-yl]methoxy}-6-methyloxane-3,4,5-triol
(2r,3'bs,5'r,5'ar,7'r,9'r,9'ar,9'br)-7'-(acetyloxy)-5',9'-dihydroxy-3'b,9'b-dimethyl-4'-oxo-7',8',9',9'a,10',11'-hexahydro-5'h-spiro[oxirane-2,6'-phenanthro[1,2-b]furan]-5'a-ylmethyl acetate
(2r,3as,4r,6s,6ar,7r,10as)-6-(acetyloxy)-2-(furan-3-yl)-2-hydroxy-3a,4-dimethyl-8-oxo-hexahydrospiro[naphtho[4a,4-b]furan-7,2'-oxiran]-6a-ylmethyl acetate
[(2s,3r,4r)-4-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-3-yl]methyl 4-hydroxybutanoate
(1r,2e,4r,11r,12r)-1-(acetyloxy)-7-[(acetyloxy)methyl]-2,11-dimethyl-6-oxo-5,14-dioxatricyclo[9.2.1.0⁴,⁸]tetradeca-2,7-dien-12-yl (2e)-2-methylbut-2-enoate
ethyl 18-bromo-16-hydroxytricosa-8,17,19-trien-4,6-diynoate
C25H35BrO3 (462.17694200000005)
1-(acetyloxy)-7-[(acetyloxy)methyl]-2,11-dimethyl-6-oxo-5,14-dioxatricyclo[9.2.1.0⁴,⁸]tetradeca-2,7-dien-12-yl 2-methylbut-2-enoate
2'-(acetyloxy)-5''-(furan-3-yl)-8'-hydroxy-6'-methyl-2''-oxo-hexahydro-2'h-dispiro[oxirane-2,1'-naphthalene-5',3''-oxolan]-8'a-ylmethyl acetate
5-methyl-11-{5-methylindolo[3,2-b]quinolin-11-yl}indolo[3,2-b]quinoline
(2r,2''s,4'ar,5's,5''s,6's,7'r,8'ar)-2''-(acetyloxy)-5''-(furan-3-yl)-7'-hydroxy-6'-methyl-8'-oxo-hexahydrodispiro[oxirane-2,1'-naphthalene-5',3''-oxolan]-8'a-ylmethyl acetate
(2r,2as,4as,7as,7br)-3-formyl-2a-methoxy-6,6,7b-trimethyl-1h,2h,4ah,5h,7h,7ah-cyclobuta[e]inden-2-yl 3-chloro-6-hydroxy-4-methoxy-2-methylbenzoate
11-chloro-10,15-dihydroxy-6,14,18,18,22-pentamethyl-7,13-dioxapentacyclo[12.8.0.0³,¹².0⁴,⁹.0¹⁷,²²]docosa-3,9,11-triene-8,19-dione
(1r,2e,4r,11s,12s)-1-(acetyloxy)-7-[(acetyloxy)methyl]-2,11-dimethyl-6-oxo-5,14-dioxatricyclo[9.2.1.0⁴,⁸]tetradeca-2,7-dien-12-yl (2e)-2-methylbut-2-enoate
ethyl (8e,16r,17e,19e)-18-bromo-16-hydroxytricosa-8,17,19-trien-4,6-diynoate
C25H35BrO3 (462.17694200000005)