Exact Mass: 462.1790776

Exact Mass Matches: 462.1790776

Found 265 metabolites which its exact mass value is equals to given mass value 462.1790776, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

   

Verbasoside

2-({2-[2-(3,4-dihydroxyphenyl)ethoxy]-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl}oxy)-6-methyloxane-3,4,5-triol

C20H30O12 (462.173718)


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

3-Formyl-2a,4a,7-trihydroxy-6-(hydroxymethyl)-6,7b-dimethyl-1H,2H,2ah,4ah,5H,6H,7H,7ah,7BH-cyclobuta[e]inden-2-yl 2-hydroxy-4-methoxy-6-methylbenzoic acid

C24H30O9 (462.18897300000003)


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

Methyl (3S)-3-[(1R,2S,6S,10S,11R,14S)-11-(furan-3-yl)-3-hydroxy-2,6,10-trimethyl-4,13-dioxo-12,15-dioxatetracyclo[8.5.0.0¹,¹⁴.0²,⁷]pentadecan-6-yl]-3-hydroxypropanoic acid

C24H30O9 (462.18897300000003)


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

3-Formyl-2a-methoxy-6,6,7b-trimethyl-1H,2H,2ah,4ah,5H,6H,7H,7ah,7BH-cyclobuta[e]inden-2-yl 3-chloro-6-hydroxy-4-methoxy-2-methylbenzoic acid

C25H31ClO6 (462.1809056)


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

2-{2-chloro-4-formyl-5-hydroxy-3-methyl-6-[3-methyl-5-(1,2,6-trimethyl-3-oxocyclohexyl)penta-2,4-dien-1-yl]phenoxy}acetic acid

C25H31ClO6 (462.1809056)


   

N-(3-(4-Methylpiperazin-1-yl)phenyl)-8-(4-(methylsulfonyl)phenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine

8-(4-Methanesulphonylphenyl)-N-[3-(4-methylpiperazin-1-yl)phenyl]-2H,3H-[1,2,4]triazolo[1,5-a]pyridin-2-imine

C24H26N6O2S (462.1837856)


   

ForsythosideE

(2R,3R,4S,5S,6R)-2-(3,4-Dihydroxyphenethoxy)-6-((((2R,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyltetrahydro-2H-pyran-2-yl)oxy)methyl)tetrahydro-2H-pyran-3,4,5-triol

C20H30O12 (462.173718)


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

[9-Acetyloxy-6-(acetyloxymethyl)-10-methyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] 4-hydroxy-2-methylbut-2-enoate

C24H30O9 (462.18897300000003)


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

[9-Acetyloxy-6-(acetyloxymethyl)-10-methyl-3-methylidene-2-oxo-3a,4,5,8,9,11a-hexahydrocyclodeca[b]furan-4-yl] 4-hydroxy-2-methylbut-2-enoate

C24H30O9 (462.18897300000003)


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 E

C20H30O12 (462.173718)


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].

   
   
   
   
   
   
   
   
   
   

6-Acetyl-10-hydroxy-teucjaponin B

(+)-6-Acetyl-10-hydroxy-teucjaponin B

C24H30O9 (462.18897300000003)


   
   

ircinianin sulfate

ircinianin sulfate

C24H30O7S (462.171215)


   

ent-18-Hydroxytrachyloban-3-one

ent-18-Hydroxytrachyloban-3-one

C20H30O12 (462.173718)


   

7-(3,4-dihydroxyphenyl)-1-(4-hydroxyphenyl)-5-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyheptan-3-one

7-(3,4-dihydroxyphenyl)-1-(4-hydroxyphenyl)-5-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyheptan-3-one

C24H30O9 (462.18897300000003)


   

3beta-hydroxy-8alpha-(2,3-diacetoxy-2-methylbutyryloxy)-eremanthin|3beta-hydroxy-8alpha-<2,3-diacetoxy-2-methylbutyryloxy>-eremanthin

3beta-hydroxy-8alpha-(2,3-diacetoxy-2-methylbutyryloxy)-eremanthin|3beta-hydroxy-8alpha-<2,3-diacetoxy-2-methylbutyryloxy>-eremanthin

C24H30O9 (462.18897300000003)


   
   

(+)-arborone|3-hydroxymethyl-4-(3,4,5-trimethoxybenzoyl)-2-(3,4,5-trimethoxyphenyl)-2,3-cis-3,4-trans-tetrahydrofuran

(+)-arborone|3-hydroxymethyl-4-(3,4,5-trimethoxybenzoyl)-2-(3,4,5-trimethoxyphenyl)-2,3-cis-3,4-trans-tetrahydrofuran

C24H30O9 (462.18897300000003)


   
   
   

coetsin B

coetsin B

C24H30O9 (462.18897300000003)


A natural product found in Isodon eriocalyx.

   
   
   

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

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

C26H26N2O6 (462.1790776)


   
   
   
   

8-desacyl-2-epi-glaucolide E tiglate

8-desacyl-2-epi-glaucolide E tiglate

C24H30O9 (462.18897300000003)


   

1-O-beta-D-glucopyranosyl-1S,4aS,5S,7aS-tetrahydro-5alpha-butoxy-7-(hydroxymethyl)-cyclopenta[c]pyran-4-carboxylic acid|rhodolatouside A

1-O-beta-D-glucopyranosyl-1S,4aS,5S,7aS-tetrahydro-5alpha-butoxy-7-(hydroxymethyl)-cyclopenta[c]pyran-4-carboxylic acid|rhodolatouside A

C20H30O12 (462.173718)


   

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

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

C20H30O12 (462.173718)


   

8-desacyl-13-acetoxyrolandrolide-8-O-tiglate

8-desacyl-13-acetoxyrolandrolide-8-O-tiglate

C24H30O9 (462.18897300000003)


   

6-acetyl-10-hydroxy-teucjaponin B|6-acetyl-10-hydroxyteucjaponin B

6-acetyl-10-hydroxy-teucjaponin B|6-acetyl-10-hydroxyteucjaponin B

C24H30O9 (462.18897300000003)


   

(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

(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

C24H30O9 (462.18897300000003)


   

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

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

C20H30O12 (462.173718)


   

(7S,8R)-3,3-didemethoxydihydrodehydrodiconiferyl alcohol 4-O-beta-D-glucopyranoside|isocupressoside B

(7S,8R)-3,3-didemethoxydihydrodehydrodiconiferyl alcohol 4-O-beta-D-glucopyranoside|isocupressoside B

C24H30O9 (462.18897300000003)


   

salvicin B|[(2S,3R,4R)-4-hydroxy-4-(4-hydroxy-3-methoxybenzyl)-2-(4-hydroxy-3-methoxyphenyl)tetrahydro-3-furanyl]methyl 4-hydroxy-butanoate

salvicin B|[(2S,3R,4R)-4-hydroxy-4-(4-hydroxy-3-methoxybenzyl)-2-(4-hydroxy-3-methoxyphenyl)tetrahydro-3-furanyl]methyl 4-hydroxy-butanoate

C24H30O9 (462.18897300000003)


   

(7R,8S)-8-methyl-9-oxo-7-(3,4,5-trimethoxyphenyl)butyl 3,4,5-trimethoxybenzoate|tsangin C

(7R,8S)-8-methyl-9-oxo-7-(3,4,5-trimethoxyphenyl)butyl 3,4,5-trimethoxybenzoate|tsangin C

C24H30O9 (462.18897300000003)


   

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

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

C24H30O9 (462.18897300000003)


   

1-(3,4-Dihydroxyphenyl)-3,5-diacetoxy-7-(3,4-dihydroxy-5-methoxyphenyl)heptane

1-(3,4-Dihydroxyphenyl)-3,5-diacetoxy-7-(3,4-dihydroxy-5-methoxyphenyl)heptane

C24H30O9 (462.18897300000003)


   

2-(4-hydroxyphenyl)-ethyl-O-beta-D-glucopyranosyl-6-O-beta-D-glucopyranoside

2-(4-hydroxyphenyl)-ethyl-O-beta-D-glucopyranosyl-6-O-beta-D-glucopyranoside

C20H30O12 (462.173718)


   

homovanillyl alcohol 4-O-beta-D-apiofuranosyl-(1?6)-beta-D-glucopyranoside|pteleifoside E

homovanillyl alcohol 4-O-beta-D-apiofuranosyl-(1?6)-beta-D-glucopyranoside|pteleifoside E

C20H30O12 (462.173718)


   

(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

(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

C24H30O9 (462.18897300000003)


   

2-methoxy-4-hydroxymethylphenol 1-O-alpha-rhamnopyranosyl-(1->6)-beta-D-glucopyranoside

2-methoxy-4-hydroxymethylphenol 1-O-alpha-rhamnopyranosyl-(1->6)-beta-D-glucopyranoside

C20H30O12 (462.173718)


   
   

2alpha,13-diacetoxy-4-hydroxy-8alpha-tigloyloxybourbonen-12,6alpha-olide|2alpha,13-diacetoxy-4alpha-hydroxy-8alpha-tigloyloxybourbonen-12,6alpha-olide

2alpha,13-diacetoxy-4-hydroxy-8alpha-tigloyloxybourbonen-12,6alpha-olide|2alpha,13-diacetoxy-4alpha-hydroxy-8alpha-tigloyloxybourbonen-12,6alpha-olide

C24H30O9 (462.18897300000003)


   
   

1,1-Dibenzene-6,8,9-trihydroxy-3-allyl-4-O-??-D-glucopyranoside

1,1-Dibenzene-6,8,9-trihydroxy-3-allyl-4-O-??-D-glucopyranoside

C24H30O9 (462.18897300000003)


   

3beta-acetoxy-8beta-(4-acetoxytigloyloxy)-14-hydroxycostunolide

3beta-acetoxy-8beta-(4-acetoxytigloyloxy)-14-hydroxycostunolide

C24H30O9 (462.18897300000003)


   

magnolignan A 2-O-beta-D-glucopyranoside|magnolignan A-2-O-beta-D-glucopyranoside

magnolignan A 2-O-beta-D-glucopyranoside|magnolignan A-2-O-beta-D-glucopyranoside

C24H30O9 (462.18897300000003)


   
   

2-hydroxy-5-(2-hydroxyethyl)phenol 1-O-alpha-rhamnopyranosyl-(1->6)-O-beta-glucopyranoside|calophymembranside B

2-hydroxy-5-(2-hydroxyethyl)phenol 1-O-alpha-rhamnopyranosyl-(1->6)-O-beta-glucopyranoside|calophymembranside B

C20H30O12 (462.173718)


   

3-deacetyl-20-epi-teulanigin|3-deacetyl-20-epieulanigin

3-deacetyl-20-epi-teulanigin|3-deacetyl-20-epieulanigin

C24H30O9 (462.18897300000003)


   

Ser Asn Gln Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-carbamoylpropanamido]-4-carbamoylbutanamido]butanedioic acid

C16H26N6O10 (462.1710336)


   
   
   

7-(3,4-dihydroxyphenyl)-1-(4-hydroxyphenyl)-5-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyheptan-3-one

NCGC00347678-02!7-(3,4-dihydroxyphenyl)-1-(4-hydroxyphenyl)-5-[(2S,3R,4S,5R)-3,4,5-trihydroxyoxan-2-yl]oxyheptan-3-one

C24H30O9 (462.18897300000003)


   

C20H30O12_Hexopyranoside, 3,4-dimethoxyphenyl 6-O-(6-deoxy-alpha-L-mannopyranosyl)

NCGC00381226-01_C20H30O12_Hexopyranoside, 3,4-dimethoxyphenyl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-

C20H30O12 (462.173718)


   

(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

C20H30O12 (462.173718)


   

(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

(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

C20H30O12 (462.173718)


   

Asp Met Pro Thr

(3S)-3-amino-3-{[(2S)-1-[(2S)-2-{[(1S,2R)-1-carboxy-2-hydroxypropyl]carbamoyl}pyrrolidin-1-yl]-4-(methylsulfanyl)-1-oxobutan-2-yl]carbamoyl}propanoic acid

C18H30N4O8S (462.178426)


   

Asp Met Thr Pro

(2S)-1-[(2S,3R)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-4-(methylsulfanyl)butanamido]-3-hydroxybutanoyl]pyrrolidine-2-carboxylic acid

C18H30N4O8S (462.178426)


   

Asp Asn Asn Thr

(2S,3R)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-carbamoylpropanamido]-3-carbamoylpropanamido]-3-hydroxybutanoic acid

C16H26N6O10 (462.1710336)


   

Asp Asn Gln Ser

(3S)-3-amino-3-{[(1S)-2-carbamoyl-1-{[(1S)-3-carbamoyl-1-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}propyl]carbamoyl}ethyl]carbamoyl}propanoic acid

C16H26N6O10 (462.1710336)


   

Asp Asn Ser Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-carbamoylpropanamido]-3-hydroxypropanamido]-4-carbamoylbutanoic acid

C16H26N6O10 (462.1710336)


   

Asp Asn Thr Asn

(2S)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-carbamoylpropanamido]-3-hydroxybutanamido]-3-carbamoylpropanoic acid

C16H26N6O10 (462.1710336)


   

Asp Pro Met Thr

(3S)-3-amino-4-[(2S)-2-{[(1S)-1-{[(1S,2R)-1-carboxy-2-hydroxypropyl]carbamoyl}-3-(methylsulfanyl)propyl]carbamoyl}pyrrolidin-1-yl]-4-oxobutanoic acid

C18H30N4O8S (462.178426)


   

Asp Pro Thr Met

(2S)-2-[(2S,3R)-2-{[(2S)-1-[(2S)-2-amino-3-carboxypropanoyl]pyrrolidin-2-yl]formamido}-3-hydroxybutanamido]-4-(methylsulfanyl)butanoic acid

C18H30N4O8S (462.178426)


   

Asp Gln Asn Ser

(3S)-3-amino-3-{[(1S)-3-carbamoyl-1-{[(1S)-2-carbamoyl-1-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}ethyl]carbamoyl}propyl]carbamoyl}propanoic acid

C16H26N6O10 (462.1710336)


   

Asp Gln Ser Asn

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-4-carbamoylbutanamido]-3-hydroxypropanamido]-3-carbamoylpropanoic acid

C16H26N6O10 (462.1710336)


   

Asp Ser Asn Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-hydroxypropanamido]-3-carbamoylpropanamido]-4-carbamoylbutanoic acid

C16H26N6O10 (462.1710336)


   

Asp Ser Gln Asn

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-hydroxypropanamido]-4-carbamoylbutanamido]-3-carbamoylpropanoic acid

C16H26N6O10 (462.1710336)


   

Asp Thr Met Pro

(2S)-1-[(2S)-2-[(2S,3R)-2-[(2S)-2-amino-3-carboxypropanamido]-3-hydroxybutanamido]-4-(methylsulfanyl)butanoyl]pyrrolidine-2-carboxylic acid

C18H30N4O8S (462.178426)


   

Asp Thr Asn Asn

(2S)-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-amino-3-carboxypropanamido]-3-hydroxybutanamido]-3-carbamoylpropanamido]-3-carbamoylpropanoic acid

C16H26N6O10 (462.1710336)


   

Asp Thr Pro Met

(3S)-3-amino-3-{[(2S,3R)-1-[(2S)-2-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}pyrrolidin-1-yl]-3-hydroxy-1-oxobutan-2-yl]carbamoyl}propanoic acid

C18H30N4O8S (462.178426)


   

Glu Met Pro Ser

(4S)-4-amino-4-{[(2S)-1-[(2S)-2-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}pyrrolidin-1-yl]-4-(methylsulfanyl)-1-oxobutan-2-yl]carbamoyl}butanoic acid

C18H30N4O8S (462.178426)


   

Glu Met Ser Pro

(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]-4-(methylsulfanyl)butanamido]-3-hydroxypropanoyl]pyrrolidine-2-carboxylic acid

C18H30N4O8S (462.178426)


   

Glu Asn Asn Ser

(4S)-4-amino-4-{[(1S)-2-carbamoyl-1-{[(1S)-2-carbamoyl-1-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}ethyl]carbamoyl}ethyl]carbamoyl}butanoic acid

C16H26N6O10 (462.1710336)


   

Glu Asn Ser Asn

(4S)-4-amino-4-{[(1S)-2-carbamoyl-1-{[(1S)-1-{[(1S)-2-carbamoyl-1-carboxyethyl]carbamoyl}-2-hydroxyethyl]carbamoyl}ethyl]carbamoyl}butanoic acid

C16H26N6O10 (462.1710336)


   

Glu Pro Met Ser

(4S)-4-amino-5-[(2S)-2-{[(1S)-1-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}-3-(methylsulfanyl)propyl]carbamoyl}pyrrolidin-1-yl]-5-oxopentanoic acid

C18H30N4O8S (462.178426)


   

Glu Pro Ser Met

(4S)-4-amino-5-[(2S)-2-{[(1S)-1-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}-2-hydroxyethyl]carbamoyl}pyrrolidin-1-yl]-5-oxopentanoic acid

C18H30N4O8S (462.178426)


   

Glu Ser Met Pro

(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]-3-hydroxypropanamido]-4-(methylsulfanyl)butanoyl]pyrrolidine-2-carboxylic acid

C18H30N4O8S (462.178426)


   

Glu Ser Asn Asn

(4S)-4-amino-4-{[(1S)-1-{[(1S)-2-carbamoyl-1-{[(1S)-2-carbamoyl-1-carboxyethyl]carbamoyl}ethyl]carbamoyl}-2-hydroxyethyl]carbamoyl}butanoic acid

C16H26N6O10 (462.1710336)


   

Glu Ser Pro Met

(4S)-4-amino-4-{[(2S)-1-[(2S)-2-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}pyrrolidin-1-yl]-3-hydroxy-1-oxopropan-2-yl]carbamoyl}butanoic acid

C18H30N4O8S (462.178426)


   

Gly His Ser Tyr

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-(1H-imidazol-4-yl)propanamido]-3-hydroxypropanamido]-3-(4-hydroxyphenyl)propanoic acid

C20H26N6O7 (462.1862886)


   

Gly His Tyr Ser

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-(1H-imidazol-4-yl)propanamido]-3-(4-hydroxyphenyl)propanamido]-3-hydroxypropanoic acid

C20H26N6O7 (462.1862886)


   

Gly Asn Ser Trp

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-carbamoylpropanamido]-3-hydroxypropanamido]-3-(1H-indol-3-yl)propanoic acid

C20H26N6O7 (462.1862886)


   

Gly Asn Trp Ser

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-carbamoylpropanamido]-3-(1H-indol-3-yl)propanamido]-3-hydroxypropanoic acid

C20H26N6O7 (462.1862886)


   

Gly Ser His Tyr

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-hydroxypropanamido]-3-(1H-imidazol-4-yl)propanamido]-3-(4-hydroxyphenyl)propanoic acid

C20H26N6O7 (462.1862886)


   

Gly Ser Asn Trp

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-hydroxypropanamido]-3-carbamoylpropanamido]-3-(1H-indol-3-yl)propanoic acid

C20H26N6O7 (462.1862886)


   

Gly Ser Trp Asn

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-hydroxypropanamido]-3-(1H-indol-3-yl)propanamido]-3-carbamoylpropanoic acid

C20H26N6O7 (462.1862886)


   

Gly Ser Tyr His

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-hydroxypropanamido]-3-(4-hydroxyphenyl)propanamido]-3-(1H-imidazol-4-yl)propanoic acid

C20H26N6O7 (462.1862886)


   

Gly Trp Asn Ser

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-(1H-indol-3-yl)propanamido]-3-carbamoylpropanamido]-3-hydroxypropanoic acid

C20H26N6O7 (462.1862886)


   

Gly Trp Ser Asn

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-(1H-indol-3-yl)propanamido]-3-hydroxypropanamido]-3-carbamoylpropanoic acid

C20H26N6O7 (462.1862886)


   

Gly Tyr His Ser

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-(4-hydroxyphenyl)propanamido]-3-(1H-imidazol-4-yl)propanamido]-3-hydroxypropanoic acid

C20H26N6O7 (462.1862886)


   

Gly Tyr Ser His

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-(4-hydroxyphenyl)propanamido]-3-hydroxypropanamido]-3-(1H-imidazol-4-yl)propanoic acid

C20H26N6O7 (462.1862886)


   

His Gly Ser Tyr

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]acetamido}-3-hydroxypropanamido]-3-(4-hydroxyphenyl)propanoic acid

C20H26N6O7 (462.1862886)


   

His Gly Tyr Ser

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]acetamido}-3-(4-hydroxyphenyl)propanamido]-3-hydroxypropanoic acid

C20H26N6O7 (462.1862886)


   

His Ser Gly Tyr

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-hydroxypropanamido]acetamido}-3-(4-hydroxyphenyl)propanoic acid

C20H26N6O7 (462.1862886)


   

His Ser Tyr Gly

2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-hydroxypropanamido]-3-(4-hydroxyphenyl)propanamido]acetic acid

C20H26N6O7 (462.1862886)


   

His Tyr Gly Ser

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-(4-hydroxyphenyl)propanamido]acetamido}-3-hydroxypropanoic acid

C20H26N6O7 (462.1862886)


   

His Tyr Ser Gly

2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-(4-hydroxyphenyl)propanamido]-3-hydroxypropanamido]acetic acid

C20H26N6O7 (462.1862886)


   

Met Asp Pro Thr

(3S)-3-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-4-[(2S)-2-{[(1S,2R)-1-carboxy-2-hydroxypropyl]carbamoyl}pyrrolidin-1-yl]-4-oxobutanoic acid

C18H30N4O8S (462.178426)


   

Met Asp Thr Pro

(2S)-1-[(2S,3R)-2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-carboxypropanamido]-3-hydroxybutanoyl]pyrrolidine-2-carboxylic acid

C18H30N4O8S (462.178426)


   

Met Glu Pro Ser

(4S)-4-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-5-[(2S)-2-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}pyrrolidin-1-yl]-5-oxopentanoic acid

C18H30N4O8S (462.178426)


   

Met Glu Ser Pro

(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-4-carboxybutanamido]-3-hydroxypropanoyl]pyrrolidine-2-carboxylic acid

C18H30N4O8S (462.178426)


   

Met Pro Asp Thr

(2S,3R)-2-[(2S)-2-{[(2S)-1-[(2S)-2-amino-4-(methylsulfanyl)butanoyl]pyrrolidin-2-yl]formamido}-3-carboxypropanamido]-3-hydroxybutanoic acid

C18H30N4O8S (462.178426)


   

Met Pro Glu Ser

(4S)-4-{[(2S)-1-[(2S)-2-amino-4-(methylsulfanyl)butanoyl]pyrrolidin-2-yl]formamido}-4-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}butanoic acid

C18H30N4O8S (462.178426)


   

Met Pro Ser Glu

(2S)-2-[(2S)-2-{[(2S)-1-[(2S)-2-amino-4-(methylsulfanyl)butanoyl]pyrrolidin-2-yl]formamido}-3-hydroxypropanamido]pentanedioic acid

C18H30N4O8S (462.178426)


   

Met Pro Thr Asp

(2S)-2-[(2S,3R)-2-{[(2S)-1-[(2S)-2-amino-4-(methylsulfanyl)butanoyl]pyrrolidin-2-yl]formamido}-3-hydroxybutanamido]butanedioic acid

C18H30N4O8S (462.178426)


   

Met Ser Glu Pro

(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-hydroxypropanamido]-4-carboxybutanoyl]pyrrolidine-2-carboxylic acid

C18H30N4O8S (462.178426)


   

Met Ser Pro Glu

(2S)-2-{[(2S)-1-[(2S)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-hydroxypropanoyl]pyrrolidin-2-yl]formamido}pentanedioic acid

C18H30N4O8S (462.178426)


   

Met Thr Asp Pro

(2S)-1-[(2S)-2-[(2S,3R)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-hydroxybutanamido]-3-carboxypropanoyl]pyrrolidine-2-carboxylic acid

C18H30N4O8S (462.178426)


   

Met Thr Pro Asp

(2S)-2-{[(2S)-1-[(2S,3R)-2-[(2S)-2-amino-4-(methylsulfanyl)butanamido]-3-hydroxybutanoyl]pyrrolidin-2-yl]formamido}butanedioic acid

C18H30N4O8S (462.178426)


   

Asn Asp Asn Thr

(2S,3R)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-carboxypropanamido]-3-carbamoylpropanamido]-3-hydroxybutanoic acid

C16H26N6O10 (462.1710336)


   

Asn Asp Gln Ser

(3S)-3-[(2S)-2-amino-3-carbamoylpropanamido]-3-{[(1S)-3-carbamoyl-1-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}propyl]carbamoyl}propanoic acid

C16H26N6O10 (462.1710336)


   

Asn Asp Ser Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-carboxypropanamido]-3-hydroxypropanamido]-4-carbamoylbutanoic acid

C16H26N6O10 (462.1710336)


   

Asn Asp Thr Asn

(2S)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-carboxypropanamido]-3-hydroxybutanamido]-3-carbamoylpropanoic acid

C16H26N6O10 (462.1710336)


   

Asn Glu Asn Ser

(4S)-4-[(2S)-2-amino-3-carbamoylpropanamido]-4-{[(1S)-2-carbamoyl-1-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}ethyl]carbamoyl}butanoic acid

C16H26N6O10 (462.1710336)


   

Asn Glu Ser Asn

(4S)-4-[(2S)-2-amino-3-carbamoylpropanamido]-4-{[(1S)-1-{[(1S)-2-carbamoyl-1-carboxyethyl]carbamoyl}-2-hydroxyethyl]carbamoyl}butanoic acid

C16H26N6O10 (462.1710336)


   

Asn Gly Ser Trp

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-3-carbamoylpropanamido]acetamido}-3-hydroxypropanamido]-3-(1H-indol-3-yl)propanoic acid

C20H26N6O7 (462.1862886)


   

Asn Gly Trp Ser

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-3-carbamoylpropanamido]acetamido}-3-(1H-indol-3-yl)propanamido]-3-hydroxypropanoic acid

C20H26N6O7 (462.1862886)


   

Asn Asn Asp Thr

(2S,3R)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-carbamoylpropanamido]-3-carboxypropanamido]-3-hydroxybutanoic acid

C16H26N6O10 (462.1710336)


   

Asn Asn Glu Ser

(4S)-4-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-carbamoylpropanamido]-4-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}butanoic acid

C16H26N6O10 (462.1710336)


   

Asn Asn Ser Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-carbamoylpropanamido]-3-hydroxypropanamido]pentanedioic acid

C16H26N6O10 (462.1710336)


   

Asn Asn Thr Asp

(2S)-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-carbamoylpropanamido]-3-hydroxybutanamido]butanedioic acid

C16H26N6O10 (462.1710336)


   

Asn Gln Asp Ser

(3S)-3-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-4-carbamoylbutanamido]-3-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}propanoic acid

C16H26N6O10 (462.1710336)


   

Asn Gln Ser Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-4-carbamoylbutanamido]-3-hydroxypropanamido]butanedioic acid

C16H26N6O10 (462.1710336)


   

Asn Ser Asp Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-hydroxypropanamido]-3-carboxypropanamido]-4-carbamoylbutanoic acid

C16H26N6O10 (462.1710336)


   

Asn Ser Glu Asn

(4S)-4-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-hydroxypropanamido]-4-{[(1S)-2-carbamoyl-1-carboxyethyl]carbamoyl}butanoic acid

C16H26N6O10 (462.1710336)


   

Asn Ser Gly Trp

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-hydroxypropanamido]acetamido}-3-(1H-indol-3-yl)propanoic acid

C20H26N6O7 (462.1862886)


   

Asn Ser Asn Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-hydroxypropanamido]-3-carbamoylpropanamido]pentanedioic acid

C16H26N6O10 (462.1710336)


   

Asn Ser Gln Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-hydroxypropanamido]-4-carbamoylbutanamido]butanedioic acid

C16H26N6O10 (462.1710336)


   

Asn Ser Trp Gly

2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-hydroxypropanamido]-3-(1H-indol-3-yl)propanamido]acetic acid

C20H26N6O7 (462.1862886)


   

Asn Thr Asp Asn

(3S)-3-[(2S,3R)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-hydroxybutanamido]-3-{[(1S)-2-carbamoyl-1-carboxyethyl]carbamoyl}propanoic acid

C16H26N6O10 (462.1710336)


   

Asn Thr Asn Asp

(2S)-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-hydroxybutanamido]-3-carbamoylpropanamido]butanedioic acid

C16H26N6O10 (462.1710336)


   

Asn Trp Gly Ser

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-(1H-indol-3-yl)propanamido]acetamido}-3-hydroxypropanoic acid

C20H26N6O7 (462.1862886)


   

Asn Trp Ser Gly

2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-(1H-indol-3-yl)propanamido]-3-hydroxypropanamido]acetic acid

C20H26N6O7 (462.1862886)


   

Pro Asp Met Thr

(2S,3R)-2-[(2S)-2-[(2S)-3-carboxy-2-[(2S)-pyrrolidin-2-ylformamido]propanamido]-4-(methylsulfanyl)butanamido]-3-hydroxybutanoic acid

C18H30N4O8S (462.178426)


   

Pro Asp Thr Met

(2S)-2-[(2S,3R)-2-[(2S)-3-carboxy-2-[(2S)-pyrrolidin-2-ylformamido]propanamido]-3-hydroxybutanamido]-4-(methylsulfanyl)butanoic acid

C18H30N4O8S (462.178426)


   

Pro Glu Met Ser

(4S)-4-{[(1S)-1-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}-3-(methylsulfanyl)propyl]carbamoyl}-4-[(2S)-pyrrolidin-2-ylformamido]butanoic acid

C18H30N4O8S (462.178426)


   

Pro Glu Ser Met

(4S)-4-{[(1S)-1-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}-2-hydroxyethyl]carbamoyl}-4-[(2S)-pyrrolidin-2-ylformamido]butanoic acid

C18H30N4O8S (462.178426)


   

Pro Met Asp Thr

(2S,3R)-2-[(2S)-3-carboxy-2-[(2S)-4-(methylsulfanyl)-2-[(2S)-pyrrolidin-2-ylformamido]butanamido]propanamido]-3-hydroxybutanoic acid

C18H30N4O8S (462.178426)


   

Pro Met Glu Ser

(4S)-4-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}-4-[(2S)-4-(methylsulfanyl)-2-[(2S)-pyrrolidin-2-ylformamido]butanamido]butanoic acid

C18H30N4O8S (462.178426)


   

Pro Met Ser Glu

(2S)-2-[(2S)-3-hydroxy-2-[(2S)-4-(methylsulfanyl)-2-[(2S)-pyrrolidin-2-ylformamido]butanamido]propanamido]pentanedioic acid

C18H30N4O8S (462.178426)


   

Pro Met Thr Asp

(2S)-2-[(2S,3R)-3-hydroxy-2-[(2S)-4-(methylsulfanyl)-2-[(2S)-pyrrolidin-2-ylformamido]butanamido]butanamido]butanedioic acid

C18H30N4O8S (462.178426)


   

Pro Ser Glu Met

(4S)-4-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}-4-[(2S)-3-hydroxy-2-[(2S)-pyrrolidin-2-ylformamido]propanamido]butanoic acid

C18H30N4O8S (462.178426)


   

Pro Ser Met Glu

(2S)-2-[(2S)-2-[(2S)-3-hydroxy-2-[(2S)-pyrrolidin-2-ylformamido]propanamido]-4-(methylsulfanyl)butanamido]pentanedioic acid

C18H30N4O8S (462.178426)


   

Pro Thr Asp Met

(2S)-2-[(2S)-3-carboxy-2-[(2S,3R)-3-hydroxy-2-[(2S)-pyrrolidin-2-ylformamido]butanamido]propanamido]-4-(methylsulfanyl)butanoic acid

C18H30N4O8S (462.178426)


   

Pro Thr Met Asp

(2S)-2-[(2S)-2-[(2S,3R)-3-hydroxy-2-[(2S)-pyrrolidin-2-ylformamido]butanamido]-4-(methylsulfanyl)butanamido]butanedioic acid

C18H30N4O8S (462.178426)


   

Gln Asp Asn Ser

(3S)-3-[(2S)-2-amino-4-carbamoylbutanamido]-3-{[(1S)-2-carbamoyl-1-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}ethyl]carbamoyl}propanoic acid

C16H26N6O10 (462.1710336)


   

Gln Asp Ser Asn

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-carboxypropanamido]-3-hydroxypropanamido]-3-carbamoylpropanoic acid

C16H26N6O10 (462.1710336)


   

Gln Asn Asp Ser

(3S)-3-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-carbamoylpropanamido]-3-{[(1S)-1-carboxy-2-hydroxyethyl]carbamoyl}propanoic acid

C16H26N6O10 (462.1710336)


   

Gln Asn Ser Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-carbamoylpropanamido]-3-hydroxypropanamido]butanedioic acid

C16H26N6O10 (462.1710336)


   

Gln Ser Asp Asn

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-hydroxypropanamido]-3-carboxypropanamido]-3-carbamoylpropanoic acid

C16H26N6O10 (462.1710336)


   

Gln Ser Asn Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-hydroxypropanamido]-3-carbamoylpropanamido]butanedioic acid

C16H26N6O10 (462.1710336)


   
   

Ser Asp Asn Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-carboxypropanamido]-3-carbamoylpropanamido]-4-carbamoylbutanoic acid

C16H26N6O10 (462.1710336)


   

Ser Asp Gln Asn

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-carboxypropanamido]-4-carbamoylbutanamido]-3-carbamoylpropanoic acid

C16H26N6O10 (462.1710336)


   

Ser Glu Met Pro

(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-4-carboxybutanamido]-4-(methylsulfanyl)butanoyl]pyrrolidine-2-carboxylic acid

C18H30N4O8S (462.178426)


   

Ser Glu Asn Asn

(4S)-4-[(2S)-2-amino-3-hydroxypropanamido]-4-{[(1S)-2-carbamoyl-1-{[(1S)-2-carbamoyl-1-carboxyethyl]carbamoyl}ethyl]carbamoyl}butanoic acid

C16H26N6O10 (462.1710336)


   

Ser Glu Pro Met

(4S)-4-[(2S)-2-amino-3-hydroxypropanamido]-5-[(2S)-2-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}pyrrolidin-1-yl]-5-oxopentanoic acid

C18H30N4O8S (462.178426)


   

Ser Gly His Tyr

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-3-hydroxypropanamido]acetamido}-3-(1H-imidazol-4-yl)propanamido]-3-(4-hydroxyphenyl)propanoic acid

C20H26N6O7 (462.1862886)


   

Ser Gly Asn Trp

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-3-hydroxypropanamido]acetamido}-3-carbamoylpropanamido]-3-(1H-indol-3-yl)propanoic acid

C20H26N6O7 (462.1862886)


   

Ser Gly Trp Asn

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-3-hydroxypropanamido]acetamido}-3-(1H-indol-3-yl)propanamido]-3-carbamoylpropanoic acid

C20H26N6O7 (462.1862886)


   

Ser Gly Tyr His

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-3-hydroxypropanamido]acetamido}-3-(4-hydroxyphenyl)propanamido]-3-(1H-imidazol-4-yl)propanoic acid

C20H26N6O7 (462.1862886)


   

Ser His Gly Tyr

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-(1H-imidazol-4-yl)propanamido]acetamido}-3-(4-hydroxyphenyl)propanoic acid

C20H26N6O7 (462.1862886)


   

Ser His Tyr Gly

2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-(1H-imidazol-4-yl)propanamido]-3-(4-hydroxyphenyl)propanamido]acetic acid

C20H26N6O7 (462.1862886)


   

Ser Met Glu Pro

(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-4-(methylsulfanyl)butanamido]-4-carboxybutanoyl]pyrrolidine-2-carboxylic acid

C18H30N4O8S (462.178426)


   

Ser Met Pro Glu

(2S)-2-{[(2S)-1-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-4-(methylsulfanyl)butanoyl]pyrrolidin-2-yl]formamido}pentanedioic acid

C18H30N4O8S (462.178426)


   

Ser Asn Asp Gln

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-carbamoylpropanamido]-3-carboxypropanamido]-4-carbamoylbutanoic acid

C16H26N6O10 (462.1710336)


   

Ser Asn Glu Asn

(4S)-4-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-carbamoylpropanamido]-4-{[(1S)-2-carbamoyl-1-carboxyethyl]carbamoyl}butanoic acid

C16H26N6O10 (462.1710336)


   

Ser Asn Gly Trp

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-carbamoylpropanamido]acetamido}-3-(1H-indol-3-yl)propanoic acid

C20H26N6O7 (462.1862886)


   

Ser Asn Asn Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-carbamoylpropanamido]-3-carbamoylpropanamido]pentanedioic acid

C16H26N6O10 (462.1710336)


   

Ser Asn Trp Gly

2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-carbamoylpropanamido]-3-(1H-indol-3-yl)propanamido]acetic acid

C20H26N6O7 (462.1862886)


   

Ser Pro Glu Met

(4S)-4-{[(2S)-1-[(2S)-2-amino-3-hydroxypropanoyl]pyrrolidin-2-yl]formamido}-4-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}butanoic acid

C18H30N4O8S (462.178426)


   

Ser Pro Met Glu

(2S)-2-[(2S)-2-{[(2S)-1-[(2S)-2-amino-3-hydroxypropanoyl]pyrrolidin-2-yl]formamido}-4-(methylsulfanyl)butanamido]pentanedioic acid

C18H30N4O8S (462.178426)


   

Ser Gln Asp Asn

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-4-carbamoylbutanamido]-3-carboxypropanamido]-3-carbamoylpropanoic acid

C16H26N6O10 (462.1710336)


   

Ser Gln Asn Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-4-carbamoylbutanamido]-3-carbamoylpropanamido]butanedioic acid

C16H26N6O10 (462.1710336)


   

Ser Trp Gly Asn

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-(1H-indol-3-yl)propanamido]acetamido}-3-carbamoylpropanoic acid

C20H26N6O7 (462.1862886)


   

Ser Trp Asn Gly

2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-(1H-indol-3-yl)propanamido]-3-carbamoylpropanamido]acetic acid

C20H26N6O7 (462.1862886)


   

Ser Tyr Gly His

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-(4-hydroxyphenyl)propanamido]acetamido}-3-(1H-imidazol-4-yl)propanoic acid

C20H26N6O7 (462.1862886)


   

Ser Tyr His Gly

2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-(4-hydroxyphenyl)propanamido]-3-(1H-imidazol-4-yl)propanamido]acetic acid

C20H26N6O7 (462.1862886)


   

Thr Asp Met Pro

(2S)-1-[(2S)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-carboxypropanamido]-4-(methylsulfanyl)butanoyl]pyrrolidine-2-carboxylic acid

C18H30N4O8S (462.178426)


   

Thr Asp Asn Asn

(3S)-3-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-{[(1S)-2-carbamoyl-1-{[(1S)-2-carbamoyl-1-carboxyethyl]carbamoyl}ethyl]carbamoyl}propanoic acid

C16H26N6O10 (462.1710336)


   

Thr Asp Pro Met

(3S)-3-[(2S,3R)-2-amino-3-hydroxybutanamido]-4-[(2S)-2-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}pyrrolidin-1-yl]-4-oxobutanoic acid

C18H30N4O8S (462.178426)


   

Thr Met Asp Pro

(2S)-1-[(2S)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-4-(methylsulfanyl)butanamido]-3-carboxypropanoyl]pyrrolidine-2-carboxylic acid

C18H30N4O8S (462.178426)


   

Thr Met Pro Asp

(2S)-2-{[(2S)-1-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-4-(methylsulfanyl)butanoyl]pyrrolidin-2-yl]formamido}butanedioic acid

C18H30N4O8S (462.178426)


   

Thr Asn Asp Asn

(3S)-3-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-carbamoylpropanamido]-3-{[(1S)-2-carbamoyl-1-carboxyethyl]carbamoyl}propanoic acid

C16H26N6O10 (462.1710336)


   

Thr Asn Asn Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-carbamoylpropanamido]-3-carbamoylpropanamido]butanedioic acid

C16H26N6O10 (462.1710336)


   

Thr Pro Asp Met

(2S)-2-[(2S)-2-{[(2S)-1-[(2S,3R)-2-amino-3-hydroxybutanoyl]pyrrolidin-2-yl]formamido}-3-carboxypropanamido]-4-(methylsulfanyl)butanoic acid

C18H30N4O8S (462.178426)


   

Thr Pro Met Asp

(2S)-2-[(2S)-2-{[(2S)-1-[(2S,3R)-2-amino-3-hydroxybutanoyl]pyrrolidin-2-yl]formamido}-4-(methylsulfanyl)butanamido]butanedioic acid

C18H30N4O8S (462.178426)


   

Trp Gly Asn Ser

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]acetamido}-3-carbamoylpropanamido]-3-hydroxypropanoic acid

C20H26N6O7 (462.1862886)


   

Trp Gly Ser Asn

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]acetamido}-3-hydroxypropanamido]-3-carbamoylpropanoic acid

C20H26N6O7 (462.1862886)


   

Trp Asn Gly Ser

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-3-carbamoylpropanamido]acetamido}-3-hydroxypropanoic acid

C20H26N6O7 (462.1862886)


   

Trp Asn Ser Gly

2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-3-carbamoylpropanamido]-3-hydroxypropanamido]acetic acid

C20H26N6O7 (462.1862886)


   

Trp Ser Gly Asn

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-3-hydroxypropanamido]acetamido}-3-carbamoylpropanoic acid

C20H26N6O7 (462.1862886)


   

Trp Ser Asn Gly

2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-3-hydroxypropanamido]-3-carbamoylpropanamido]acetic acid

C20H26N6O7 (462.1862886)


   

Tyr Gly His Ser

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]acetamido}-3-(1H-imidazol-4-yl)propanamido]-3-hydroxypropanoic acid

C20H26N6O7 (462.1862886)


   

Tyr Gly Ser His

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]acetamido}-3-hydroxypropanamido]-3-(1H-imidazol-4-yl)propanoic acid

C20H26N6O7 (462.1862886)


   

Tyr His Gly Ser

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-(1H-imidazol-4-yl)propanamido]acetamido}-3-hydroxypropanoic acid

C20H26N6O7 (462.1862886)


   

Tyr His Ser Gly

2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-(1H-imidazol-4-yl)propanamido]-3-hydroxypropanamido]acetic acid

C20H26N6O7 (462.1862886)


   

Tyr Ser Gly His

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-hydroxypropanamido]acetamido}-3-(1H-imidazol-4-yl)propanoic acid

C20H26N6O7 (462.1862886)


   

Tyr Ser His Gly

2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-hydroxypropanamido]-3-(1H-imidazol-4-yl)propanamido]acetic acid

C20H26N6O7 (462.1862886)


   

CAY10593

N-[2-[4-(5-chloro-2,3-dihydro-2-oxo-1H-benzimidazol-1-yl)-1-piperidinyl]-1-methylethyl]-2-naphthalenecarboxamide

C26H27ClN4O2 (462.1822432)


   

4-O-Methylarmillaridin

3-formyl-2a-methoxy-6,6,7b-trimethyl-1H,2H,2aH,4aH,5H,6H,7H,7aH,7bH-cyclobuta[e]inden-2-yl 3-chloro-6-hydroxy-4-methoxy-2-methylbenzoate

C25H31ClO6 (462.1809056)


   

13-Hydroxy-5'-O-methylmelledonal

3-formyl-2a,4a,7-trihydroxy-6-(hydroxymethyl)-6,7b-dimethyl-1H,2H,2aH,4aH,5H,6H,7H,7aH,7bH-cyclobuta[e]inden-2-yl 2-hydroxy-4-methoxy-6-methylbenzoate

C24H30O9 (462.18897300000003)


   

Retrocalamin

methyl 3-[11-(furan-3-yl)-3-hydroxy-2,6,10-trimethyl-4,13-dioxo-12,15-dioxatetracyclo[8.5.0.0^{1,14}.0^{2,7}]pentadecan-6-yl]-3-hydroxypropanoate

C24H30O9 (462.18897300000003)


   

Verbasoside

2-({2-[2-(3,4-dihydroxyphenyl)ethoxy]-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl}oxy)-6-methyloxane-3,4,5-triol

C20H30O12 (462.173718)


   

Ethyl 16-hydroxy-18-bromo-8E,17E19Z-tricosatrien-4,6-diynoate

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

1-(3,4-Dihydroxyphenyl)-7-(4-hydroxyphenyl)-5-oxo-3-heptanyl ?-D-xylopyranoside

C24H30O9 (462.18897300000003)


   

Ethyl 16-hydroxy-18-bromo-8E,17E19Z-tricosatrien-4,6-diynoate

Ethyl 16-hydroxy-18-bromo-8E,17E19Z-tricosatrien-4,6-diynoate

C25H35O3Br (462.176942)


   

ST 18:4;O3;GlcA

16alpha-hydroxyestrone 3-O-(beta-D-glucuronide)

C24H30O9 (462.18897300000003)


   
   
   

Cariprazine HCl

Cariprazine hydrochloride

C21H33Cl3N4O (462.1719818)


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

N-(3-(4-Methylpiperazin-1-yl)phenyl)-8-(4-(methylsulfonyl)phenyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine

C24H26N6O2S (462.1837856)


   

5,15-DIPHENYL-21H,23H-PORPHINE

5,15-DIPHENYL-21H,23H-PORPHINE

C32H22N4 (462.1844372)


   
   

Perospirone hydrochloride

Perospirone hydrochloride

C23H31ClN4O2S (462.1856136)


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].

   

9,9-Bis(4-glycidyloxyphenyl)fluorene

9,9-Bis(4-glycidyloxyphenyl)fluorene

C31H26O4 (462.18309960000005)


   
   

Abacavir 5-beta-D-Glucuronide

Abacavir 5-beta-D-Glucuronide

C20H26N6O7 (462.1862886)


   

16a-Hydroxyestrone 16-b-D-glucuronide

16a-Hydroxyestrone 16-b-D-glucuronide

C24H30O9 (462.18897300000003)


   

16alpha-hydroxy-17-oxoestra-1,3,5(10)-trien-3-yl beta-D-glucopyranosiduronic acid

16alpha-hydroxy-17-oxoestra-1,3,5(10)-trien-3-yl beta-D-glucopyranosiduronic acid

C24H30O9 (462.18897300000003)


   

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-[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

C25H31ClO6 (462.1809056)


   

Tsangin C

Tsangin C

C24H30O9 (462.18897300000003)


A natural product found in Beilschmiedia tsangii.

   
   

2-(4-Methoxyphenyl)acetic acid [2-[4-[(4-ethoxyanilino)-oxomethyl]anilino]-2-oxoethyl] ester

2-(4-Methoxyphenyl)acetic acid [2-[4-[(4-ethoxyanilino)-oxomethyl]anilino]-2-oxoethyl] ester

C26H26N2O6 (462.1790776)


   

Asp-Met-Thr-Pro

Asp-Met-Thr-Pro

C18H30N4O8S (462.178426)


A tetrapeptide composed of L-aspartic acid, L-methionine, L-threonine and L-proline joined in sequence by peptide linkages.

   

15-Hydroxy-5-O-methylmelledonal

15-Hydroxy-5-O-methylmelledonal

C24H30O9 (462.18897300000003)


   

3-hydroxy-17-oxoestra-1,3,5(10)-trien-2-yl beta-D-glucopyranosiduronic acid

3-hydroxy-17-oxoestra-1,3,5(10)-trien-2-yl beta-D-glucopyranosiduronic acid

C24H30O9 (462.18897300000003)


   

3-hydroxy-17-oxoestra-1,3,5(10)-trien-4-yl beta-D-glucopyranosiduronic acid

3-hydroxy-17-oxoestra-1,3,5(10)-trien-4-yl beta-D-glucopyranosiduronic acid

C24H30O9 (462.18897300000003)


   

(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

(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

C25H23FN4O4 (462.170325)


   

(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

(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

C25H23FN4O4 (462.170325)


   
   
   

4-hydroxy-17-oxoestra-1,3,5(10)-trien-3-yl beta-D-glucopyranosiduronic acid

4-hydroxy-17-oxoestra-1,3,5(10)-trien-3-yl beta-D-glucopyranosiduronic acid

C24H30O9 (462.18897300000003)


   

2-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

C24H30O9 (462.18897300000003)


   
   

6-O-Methylarmillaridin

6-O-Methylarmillaridin

C25H31ClO6 (462.1809056)


   

13-Hydroxy-5-O-methylmelledonal

13-Hydroxy-5-O-methylmelledonal

C24H30O9 (462.18897300000003)


   

abacavir 5-glucuronide

abacavir 5-glucuronide

C20H26N6O7 (462.1862886)


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

C23H25F3N4O3 (462.1878656)


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

C26H27ClN4O2 (462.1822432)


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].