Exact Mass: 458.2178616

Exact Mass Matches: 458.2178616

Found 111 metabolites which its exact mass value is equals to given mass value 458.2178616, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

2-Hydroxy-3-[(2-carboxyethyl)thio]-3-[2-(8-phenyloctyl)phenyl]propanoic acid

3-[(2-Carboxyethyl)sulphanyl]-2-hydroxy-3-[2-(8-phenyloctyl)phenyl]propanoic acid

C26H34O5S (458.21268340000006)


D019141 - Respiratory System Agents > D018927 - Anti-Asthmatic Agents > D020024 - Leukotriene Antagonists D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006727 - Hormone Antagonists

   

Avitriptan

3-(3-(4--(5-Methoxy-4-pyrimidinyl)-1-piperazinyl)propyl)-N-methyl-1H-indole-5-methanesulfonamide fumarate

C22H30N6O3S (458.20999900000004)


C78272 - Agent Affecting Nervous System > C29710 - Antipsychotic Agent C78272 - Agent Affecting Nervous System > C47794 - Serotonin Agonist

   
   
   

2-methyl-5-(1-methylethyl)-phenyl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside|carvacrol 2-O-alpha-L-rhamnopyranosyl-(1->6)-beta-D-glucopyranoside

2-methyl-5-(1-methylethyl)-phenyl 6-O-(6-deoxy-alpha-L-mannopyranosyl)-beta-D-glucopyranoside|carvacrol 2-O-alpha-L-rhamnopyranosyl-(1->6)-beta-D-glucopyranoside

C22H34O10 (458.2151864)


   
   

5-Hydroxy-8-(4-methyl-3-pentenyl)-8-methyl-6-(2-methyl-1-oxopropyl)-4-phenyl-2H,8H-benzo[1,2-b:3,4-b]dipyran-2-one

5-Hydroxy-8-(4-methyl-3-pentenyl)-8-methyl-6-(2-methyl-1-oxopropyl)-4-phenyl-2H,8H-benzo[1,2-b:3,4-b]dipyran-2-one

C29H30O5 (458.209313)


   

4,6-decadiyne-1-O-alpha-L-rhamnopyranosyl-(1->6)-beta-D-glucopyranoside

4,6-decadiyne-1-O-alpha-L-rhamnopyranosyl-(1->6)-beta-D-glucopyranoside

C22H34O10 (458.2151864)


   
   

9-acetoxy-gamma-geraniol-(2,6-diacetyl-beta-D-glucopyranoside)

9-acetoxy-gamma-geraniol-(2,6-diacetyl-beta-D-glucopyranoside)

C22H34O10 (458.2151864)


   

Phe Gly His Val

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

C22H30N6O5 (458.227757)


   

Phe Gly Val His

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-3-phenylpropanamido]acetamido}-3-methylbutanamido]-3-(1H-imidazol-4-yl)propanoic acid

C22H30N6O5 (458.227757)


   

Phe His Gly Val

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

C22H30N6O5 (458.227757)


   

Phe His Val Gly

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

C22H30N6O5 (458.227757)


   

Phe Val Gly His

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-3-methylbutanamido]acetamido}-3-(1H-imidazol-4-yl)propanoic acid

C22H30N6O5 (458.227757)


   

Phe Val His Gly

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

C22H30N6O5 (458.227757)


   

Gly Phe His Val

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

C22H30N6O5 (458.227757)


   

Gly Phe Val His

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-phenylpropanamido]-3-methylbutanamido]-3-(1H-imidazol-4-yl)propanoic acid

C22H30N6O5 (458.227757)


   

Gly His Phe Val

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

C22H30N6O5 (458.227757)


   

Gly His Val Phe

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

C22H30N6O5 (458.227757)


   

Gly Val Phe His

(2S)-2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-3-methylbutanamido]-3-phenylpropanamido]-3-(1H-imidazol-4-yl)propanoic acid

C22H30N6O5 (458.227757)


   

Gly Val His Phe

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

C22H30N6O5 (458.227757)


   

His Phe Gly Val

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

C22H30N6O5 (458.227757)


   

His Phe Val Gly

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

C22H30N6O5 (458.227757)


   

His Gly Phe Val

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

C22H30N6O5 (458.227757)


   

His Gly Val Phe

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

C22H30N6O5 (458.227757)


   

His Thr Thr Thr

(2S,3R)-2-[(2S,3R)-2-[(2S,3R)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-hydroxybutanamido]-3-hydroxybutanamido]-3-hydroxybutanoic acid

C18H30N6O8 (458.212502)


   

His Val Phe Gly

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

C22H30N6O5 (458.227757)


   

His Val Gly Phe

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

C22H30N6O5 (458.227757)


   

Asn Pro Gln Thr

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

C18H30N6O8 (458.212502)


   

Asn Pro Thr Gln

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

C18H30N6O8 (458.212502)


   

Asn Gln Pro Thr

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

C18H30N6O8 (458.212502)


   

Asn Gln Thr Pro

(2S)-1-[(2S,3R)-2-[(2S)-2-[(2S)-2-amino-3-carbamoylpropanamido]-4-carbamoylbutanamido]-3-hydroxybutanoyl]pyrrolidine-2-carboxylic acid

C18H30N6O8 (458.212502)


   

Asn Thr Pro Gln

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

C18H30N6O8 (458.212502)


   

Asn Thr Gln Pro

(2S)-1-[(2S)-2-[(2S,3R)-2-[(2S)-2-amino-3-carbamoylpropanamido]-3-hydroxybutanamido]-4-carbamoylbutanoyl]pyrrolidine-2-carboxylic acid

C18H30N6O8 (458.212502)


   

Pro Asn Gln Thr

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

C18H30N6O8 (458.212502)


   

Pro Asn Thr Gln

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

C18H30N6O8 (458.212502)


   

Pro Gln Asn Thr

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

C18H30N6O8 (458.212502)


   

Pro Gln Gln Ser

(2S)-2-[(2S)-4-carbamoyl-2-[(2S)-4-carbamoyl-2-[(2S)-pyrrolidin-2-ylformamido]butanamido]butanamido]-3-hydroxypropanoic acid

C18H30N6O8 (458.212502)


   

Pro Gln Ser Gln

(2S)-4-carbamoyl-2-[(2S)-2-[(2S)-4-carbamoyl-2-[(2S)-pyrrolidin-2-ylformamido]butanamido]-3-hydroxypropanamido]butanoic acid

C18H30N6O8 (458.212502)


   

Pro Gln Thr Asn

(2S)-3-carbamoyl-2-[(2S,3R)-2-[(2S)-4-carbamoyl-2-[(2S)-pyrrolidin-2-ylformamido]butanamido]-3-hydroxybutanamido]propanoic acid

C18H30N6O8 (458.212502)


   

Pro Ser Gln Gln

(2S)-4-carbamoyl-2-[(2S)-4-carbamoyl-2-[(2S)-3-hydroxy-2-[(2S)-pyrrolidin-2-ylformamido]propanamido]butanamido]butanoic acid

C18H30N6O8 (458.212502)


   

Pro Thr Asn Gln

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

C18H30N6O8 (458.212502)


   

Pro Thr Gln Asn

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

C18H30N6O8 (458.212502)


   

Gln Asn Pro Thr

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

C18H30N6O8 (458.212502)


   

Gln Asn Thr Pro

(2S)-1-[(2S,3R)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-carbamoylpropanamido]-3-hydroxybutanoyl]pyrrolidine-2-carboxylic acid

C18H30N6O8 (458.212502)


   

Gln Pro Asn Thr

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

C18H30N6O8 (458.212502)


   

Gln Pro Gln Ser

(2S)-2-[(2S)-2-{[(2S)-1-[(2S)-2-amino-4-carbamoylbutanoyl]pyrrolidin-2-yl]formamido}-4-carbamoylbutanamido]-3-hydroxypropanoic acid

C18H30N6O8 (458.212502)


   

Gln Pro Ser Gln

(2S)-2-[(2S)-2-{[(2S)-1-[(2S)-2-amino-4-carbamoylbutanoyl]pyrrolidin-2-yl]formamido}-3-hydroxypropanamido]-4-carbamoylbutanoic acid

C18H30N6O8 (458.212502)


   

Gln Pro Thr Asn

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

C18H30N6O8 (458.212502)


   

Gln Gln Pro Ser

(2S)-2-{[(2S)-1-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-4-carbamoylbutanoyl]pyrrolidin-2-yl]formamido}-3-hydroxypropanoic acid

C18H30N6O8 (458.212502)


   

Gln Gln Ser Pro

(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-4-carbamoylbutanamido]-3-hydroxypropanoyl]pyrrolidine-2-carboxylic acid

C18H30N6O8 (458.212502)


   

Gln Ser Pro Gln

(2S)-2-{[(2S)-1-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-hydroxypropanoyl]pyrrolidin-2-yl]formamido}-4-carbamoylbutanoic acid

C18H30N6O8 (458.212502)


   

Gln Ser Gln Pro

(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-hydroxypropanamido]-4-carbamoylbutanoyl]pyrrolidine-2-carboxylic acid

C18H30N6O8 (458.212502)


   

Gln Thr Asn Pro

(2S)-1-[(2S)-2-[(2S,3R)-2-[(2S)-2-amino-4-carbamoylbutanamido]-3-hydroxybutanamido]-3-carbamoylpropanoyl]pyrrolidine-2-carboxylic acid

C18H30N6O8 (458.212502)


   

Gln Thr Pro Asn

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

C18H30N6O8 (458.212502)


   

Ser Pro Gln Gln

(2S)-2-[(2S)-2-{[(2S)-1-[(2S)-2-amino-3-hydroxypropanoyl]pyrrolidin-2-yl]formamido}-4-carbamoylbutanamido]-4-carbamoylbutanoic acid

C18H30N6O8 (458.212502)


   

Ser Gln Pro Gln

(2S)-2-{[(2S)-1-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-4-carbamoylbutanoyl]pyrrolidin-2-yl]formamido}-4-carbamoylbutanoic acid

C18H30N6O8 (458.212502)


   

Ser Gln Gln Pro

(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-4-carbamoylbutanamido]-4-carbamoylbutanoyl]pyrrolidine-2-carboxylic acid

C18H30N6O8 (458.212502)


   

Thr His Thr Thr

(2S,3R)-2-[(2S,3R)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-(1H-imidazol-4-yl)propanamido]-3-hydroxybutanamido]-3-hydroxybutanoic acid

C18H30N6O8 (458.212502)


   

Thr Asn Pro Gln

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

C18H30N6O8 (458.212502)


   

Thr Asn Gln Pro

(2S)-1-[(2S)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-carbamoylpropanamido]-4-carbamoylbutanoyl]pyrrolidine-2-carboxylic acid

C18H30N6O8 (458.212502)


   

Thr Pro Asn Gln

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

C18H30N6O8 (458.212502)


   

Thr Pro Gln Asn

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

C18H30N6O8 (458.212502)


   

Thr Gln Asn Pro

(2S)-1-[(2S)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-4-carbamoylbutanamido]-3-carbamoylpropanoyl]pyrrolidine-2-carboxylic acid

C18H30N6O8 (458.212502)


   

Thr Gln Pro Asn

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

C18H30N6O8 (458.212502)


   

Thr Thr His Thr

(2S,3R)-2-[(2S)-2-[(2S,3R)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-hydroxybutanamido]-3-(1H-imidazol-4-yl)propanamido]-3-hydroxybutanoic acid

C18H30N6O8 (458.212502)


   

Thr Thr Thr His

(2S)-2-[(2S,3R)-2-[(2S,3R)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-hydroxybutanamido]-3-hydroxybutanamido]-3-(1H-imidazol-4-yl)propanoic acid

C18H30N6O8 (458.212502)


   

Val Phe Gly His

(2S)-2-{2-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]-3-phenylpropanamido]acetamido}-3-(1H-imidazol-4-yl)propanoic acid

C22H30N6O5 (458.227757)


   

Val Phe His Gly

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

C22H30N6O5 (458.227757)


   

Val Gly Phe His

(2S)-2-[(2S)-2-{2-[(2S)-2-amino-3-methylbutanamido]acetamido}-3-phenylpropanamido]-3-(1H-imidazol-4-yl)propanoic acid

C22H30N6O5 (458.227757)


   

Val Gly His Phe

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

C22H30N6O5 (458.227757)


   

Val His Phe Gly

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

C22H30N6O5 (458.227757)


   

Val His Gly Phe

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

C22H30N6O5 (458.227757)


   

decanedioic acid,dimethyl benzene-1,4-dicarboxylate,ethane-1,2-diol

decanedioic acid,dimethyl benzene-1,4-dicarboxylate,ethane-1,2-diol

C22H34O10 (458.2151864)


   

5-[(1R)-1-Hydroxy-2-[[(1R)-2-(4-methoxyphenyl)-1-methylethyl]amino]ethyl]-8-(phenylmethoxy)-2(1H)-quinolinone

5-[(1R)-1-Hydroxy-2-[[(1R)-2-(4-methoxyphenyl)-1-methylethyl]amino]ethyl]-8-(phenylmethoxy)-2(1H)-quinolinone

C28H30N2O4 (458.220546)


   

2-C-(2,3,4,6-Tetra-O-benzyl-a-D-glucopyranosyl) ethyne

2-C-(2,3,4,6-Tetra-O-benzyl-a-D-glucopyranosyl) ethyne

C29H30O5 (458.209313)


   

4-(8-((4-((1S,4S)-5-Isopropyl-2,5-diazabicyclo(2.2.1)heptan-2-yl)phenyl)amino)-(1,2,4)triazolo(1,5-a)pyrazin-5-yl)furan-2-carboxamide

4-(8-((4-((1S,4S)-5-Isopropyl-2,5-diazabicyclo(2.2.1)heptan-2-yl)phenyl)amino)-(1,2,4)triazolo(1,5-a)pyrazin-5-yl)furan-2-carboxamide

C24H26N8O2 (458.2178616)


   

2-amino-N-[5-[(6-dimethylamino-9H-purin-9-yl)]-4-hydroxy-2-(hydroxymethyl)tetrahydrofuran-3-yl]-3-(4-hydroxyphenyl)-propanamid

2-amino-N-[5-[(6-dimethylamino-9H-purin-9-yl)]-4-hydroxy-2-(hydroxymethyl)tetrahydrofuran-3-yl]-3-(4-hydroxyphenyl)-propanamid

C21H28N7O5+ (458.21518180000004)


   

O-demethylpuromycin(1+)

O-demethylpuromycin(1+)

C21H28N7O5+ (458.21518180000004)


The conjugate acid of O-demethylpuromycin; major species at pH 7.3.

   

(6R,7S,8S)-8-(hydroxymethyl)-4-[4-oxanyl(oxo)methyl]-7-[4-(3-phenylprop-1-ynyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one

(6R,7S,8S)-8-(hydroxymethyl)-4-[4-oxanyl(oxo)methyl]-7-[4-(3-phenylprop-1-ynyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one

C28H30N2O4 (458.220546)


   

(6S,7S,8S)-8-(hydroxymethyl)-4-[4-oxanyl(oxo)methyl]-7-[4-(3-phenylprop-1-ynyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one

(6S,7S,8S)-8-(hydroxymethyl)-4-[4-oxanyl(oxo)methyl]-7-[4-(3-phenylprop-1-ynyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one

C28H30N2O4 (458.220546)


   

(6S,7R,8S)-8-(hydroxymethyl)-4-[4-oxanyl(oxo)methyl]-7-[4-(3-phenylprop-1-ynyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one

(6S,7R,8S)-8-(hydroxymethyl)-4-[4-oxanyl(oxo)methyl]-7-[4-(3-phenylprop-1-ynyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one

C28H30N2O4 (458.220546)


   

(6R,7R,8R)-8-(hydroxymethyl)-4-[4-oxanyl(oxo)methyl]-7-[4-(3-phenylprop-1-ynyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one

(6R,7R,8R)-8-(hydroxymethyl)-4-[4-oxanyl(oxo)methyl]-7-[4-(3-phenylprop-1-ynyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one

C28H30N2O4 (458.220546)


   

(6S,7R,8R)-8-(hydroxymethyl)-4-[4-oxanyl(oxo)methyl]-7-[4-(3-phenylprop-1-ynyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one

(6S,7R,8R)-8-(hydroxymethyl)-4-[4-oxanyl(oxo)methyl]-7-[4-(3-phenylprop-1-ynyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one

C28H30N2O4 (458.220546)


   

(6S,7S,8R)-8-(hydroxymethyl)-4-[4-oxanyl(oxo)methyl]-7-[4-(3-phenylprop-1-ynyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one

(6S,7S,8R)-8-(hydroxymethyl)-4-[4-oxanyl(oxo)methyl]-7-[4-(3-phenylprop-1-ynyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one

C28H30N2O4 (458.220546)


   

(6R,7R,8S)-8-(hydroxymethyl)-4-[4-oxanyl(oxo)methyl]-7-[4-(3-phenylprop-1-ynyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one

(6R,7R,8S)-8-(hydroxymethyl)-4-[4-oxanyl(oxo)methyl]-7-[4-(3-phenylprop-1-ynyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one

C28H30N2O4 (458.220546)


   

(6R,7S,8R)-8-(hydroxymethyl)-4-[4-oxanyl(oxo)methyl]-7-[4-(3-phenylprop-1-ynyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one

(6R,7S,8R)-8-(hydroxymethyl)-4-[4-oxanyl(oxo)methyl]-7-[4-(3-phenylprop-1-ynyl)phenyl]-1,4-diazabicyclo[4.2.0]octan-2-one

C28H30N2O4 (458.220546)


   

Avitriptan

Avitriptan

C22H30N6O3S (458.20999900000004)


C78272 - Agent Affecting Nervous System > C29710 - Antipsychotic Agent C78272 - Agent Affecting Nervous System > C47794 - Serotonin Agonist

   
   
   

5-hydroxy-8-methyl-8-(4-methylpent-3-en-1-yl)-6-(2-methylpropanoyl)-4-phenylpyrano[2,3-f]chromen-2-one

5-hydroxy-8-methyl-8-(4-methylpent-3-en-1-yl)-6-(2-methylpropanoyl)-4-phenylpyrano[2,3-f]chromen-2-one

C29H30O5 (458.209313)


   

(8r)-5-hydroxy-8-methyl-8-(4-methylpent-3-en-1-yl)-6-(2-methylpropanoyl)-4-phenylpyrano[2,3-f]chromen-2-one

(8r)-5-hydroxy-8-methyl-8-(4-methylpent-3-en-1-yl)-6-(2-methylpropanoyl)-4-phenylpyrano[2,3-f]chromen-2-one

C29H30O5 (458.209313)


   

(2z,6e)-2-[(3r)-3-chloro-4-methylpent-4-en-1-yl]-9-[(2r)-6-hydroxy-2,8-dimethylchromen-2-yl]-6-methylnona-2,6-dienoic acid

(2z,6e)-2-[(3r)-3-chloro-4-methylpent-4-en-1-yl]-9-[(2r)-6-hydroxy-2,8-dimethylchromen-2-yl]-6-methylnona-2,6-dienoic acid

C27H35ClO4 (458.22237400000006)


   

2-(deca-4,6-diyn-1-yloxy)-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxane-3,4,5-triol

2-(deca-4,6-diyn-1-yloxy)-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxane-3,4,5-triol

C22H34O10 (458.2151864)


   

(2r,3r,4s,5s,6r)-2-(deca-4,6-diyn-1-yloxy)-6-({[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxane-3,4,5-triol

(2r,3r,4s,5s,6r)-2-(deca-4,6-diyn-1-yloxy)-6-({[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxane-3,4,5-triol

C22H34O10 (458.2151864)


   

5-hydroxy-6-isobutyryl-8-methyl-8-(4-methyl-pent-3-enyl)-4-phenyl-2h-pyrano[2,3-h ]chro-men-2-one

NA

C29H30O5 (458.209313)


{"Ingredient_id": "HBIN011628","Ingredient_name": "5-hydroxy-6-isobutyryl-8-methyl-8-(4-methyl-pent-3-enyl)-4-phenyl-2h-pyrano[2,3-h ]chro-men-2-one","Alias": "NA","Ingredient_formula": "C29H30O5","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "10240","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

3-oxo-3-[(3,4,5-trihydroxy-6-{[4-(2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl)butan-2-yl]oxy}oxan-2-yl)methoxy]propanoic acid

3-oxo-3-[(3,4,5-trihydroxy-6-{[4-(2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl)butan-2-yl]oxy}oxan-2-yl)methoxy]propanoic acid

C22H34O10 (458.2151864)


   

(2e,6e)-2-(3-chloro-4-methylpent-4-en-1-yl)-9-(6-hydroxy-2,8-dimethylchromen-2-yl)-6-methylnona-2,6-dienoic acid

(2e,6e)-2-(3-chloro-4-methylpent-4-en-1-yl)-9-(6-hydroxy-2,8-dimethylchromen-2-yl)-6-methylnona-2,6-dienoic acid

C27H35ClO4 (458.22237400000006)


   

(2s)-n-[(2r)-3-(acetyloxy)-2-benzylpropyl]-2-{[hydroxy(phenyl)methylidene]amino}-3-phenylpropanimidic acid

(2s)-n-[(2r)-3-(acetyloxy)-2-benzylpropyl]-2-{[hydroxy(phenyl)methylidene]amino}-3-phenylpropanimidic acid

C28H30N2O4 (458.220546)


   

2-(3-chloro-4-methylpent-4-en-1-yl)-9-(6-hydroxy-2,8-dimethylchromen-2-yl)-6-methylnona-2,6-dienoic acid

2-(3-chloro-4-methylpent-4-en-1-yl)-9-(6-hydroxy-2,8-dimethylchromen-2-yl)-6-methylnona-2,6-dienoic acid

C27H35ClO4 (458.22237400000006)


   

(2s,3r,4s,5s,6r)-2-(5-isopropyl-2-methylphenoxy)-6-({[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxane-3,4,5-triol

(2s,3r,4s,5s,6r)-2-(5-isopropyl-2-methylphenoxy)-6-({[(2r,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}methyl)oxane-3,4,5-triol

C22H34O10 (458.2151864)


   

methyl (1r,3s,3ar,8as)-1-(2-methoxy-2-oxoethyl)-3a-methyl-3-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,3,4,5,8,8a-hexahydro-1h-azulene-6-carboxylate

methyl (1r,3s,3ar,8as)-1-(2-methoxy-2-oxoethyl)-3a-methyl-3-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,3,4,5,8,8a-hexahydro-1h-azulene-6-carboxylate

C22H34O10 (458.2151864)


   

5,13,17,19-tetrahydroxy-22,22-dimethyl-7-pentylpentacyclo[12.8.0.0³,¹².0⁴,⁹.0¹⁶,²¹]docosa-1,3(12),4,6,8,13,16,18,20-nonaen-15-one

5,13,17,19-tetrahydroxy-22,22-dimethyl-7-pentylpentacyclo[12.8.0.0³,¹².0⁴,⁹.0¹⁶,²¹]docosa-1,3(12),4,6,8,13,16,18,20-nonaen-15-one

C29H30O5 (458.209313)


   

(2z,6e)-2-(3-chloro-4-methylpent-4-en-1-yl)-9-(6-hydroxy-2,8-dimethylchromen-2-yl)-6-methylnona-2,6-dienoic acid

(2z,6e)-2-(3-chloro-4-methylpent-4-en-1-yl)-9-(6-hydroxy-2,8-dimethylchromen-2-yl)-6-methylnona-2,6-dienoic acid

C27H35ClO4 (458.22237400000006)


   

3-oxo-3-{[(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-{[(2r)-4-[(1s)-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]butan-2-yl]oxy}oxan-2-yl]methoxy}propanoic acid

3-oxo-3-{[(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-{[(2r)-4-[(1s)-2,6,6-trimethyl-4-oxocyclohex-2-en-1-yl]butan-2-yl]oxy}oxan-2-yl]methoxy}propanoic acid

C22H34O10 (458.2151864)


   

methyl (1r,3s,3ar,8as)-1-(2-methoxy-2-oxoethyl)-3a-methyl-3-{[(2r,3s,4r,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,3,4,5,8,8a-hexahydro-1h-azulene-6-carboxylate

methyl (1r,3s,3ar,8as)-1-(2-methoxy-2-oxoethyl)-3a-methyl-3-{[(2r,3s,4r,5r,6s)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,3,4,5,8,8a-hexahydro-1h-azulene-6-carboxylate

C22H34O10 (458.2151864)


   

2-(5-isopropyl-2-methylphenoxy)-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxane-3,4,5-triol

2-(5-isopropyl-2-methylphenoxy)-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxane-3,4,5-triol

C22H34O10 (458.2151864)


   

(2z,6z)-2-[(3r)-3-chloro-4-methylpent-4-en-1-yl]-9-[(2r)-6-hydroxy-2,8-dimethylchromen-2-yl]-6-methylnona-2,6-dienoic acid

(2z,6z)-2-[(3r)-3-chloro-4-methylpent-4-en-1-yl]-9-[(2r)-6-hydroxy-2,8-dimethylchromen-2-yl]-6-methylnona-2,6-dienoic acid

C27H35ClO4 (458.22237400000006)


   

methyl (1r,3ar)-1-(2-methoxy-2-oxoethyl)-3a-methyl-3-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,3,4,5,8,8a-hexahydro-1h-azulene-6-carboxylate

methyl (1r,3ar)-1-(2-methoxy-2-oxoethyl)-3a-methyl-3-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-2,3,4,5,8,8a-hexahydro-1h-azulene-6-carboxylate

C22H34O10 (458.2151864)