Exact Mass: 458.1365

Exact Mass Matches: 458.1365

Found 111 metabolites which its exact mass value is equals to given mass value 458.1365, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

5a,11a-Dehydrooxytetracycline

5a,11a-Dehydrooxytetracycline

C22H22N2O9 (458.1325)


A member of the class of tetracyclines with formula C22H22N2O9 that is an intermediate in the biosynthesis of oxytetracycline by Streptomyces rimosus.

   

2'-(E)-Feruloyl-3-(arabinosylxylose)

4-Hydroxy-5-(hydroxymethyl)-2-[(2,3,5-trihydroxyoxan-4-yl)oxy]oxolan-3-yl (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic acid

C20H26O12 (458.1424)


2-(E)-Feruloyl-3-(arabinosylxylose) is found in cereals and cereal products. 2-(E)-Feruloyl-3-(arabinosylxylose) is isolated from corn hull

   

7-Hydroxy-4-methylphthalide O-[arabinosyl-(1->6)-glucoside]

4-methyl-7-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl)oxy]-1,3-dihydro-2-benzofuran-1-one

C20H26O12 (458.1424)


7-Hydroxy-4-methylphthalide O-[arabinosyl-(1->6)-glucoside] is a constituent of the bark of Quillaja saponaria (soap-bark tree). Constituent of the bark of Quillaja saponaria (soap-bark tree)

   

cis-p-Coumaric acid 4-[apiosyl-(1->2)-glucoside]

(2E)-3-{4-[(3-{[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy]phenyl}prop-2-enoic acid

C20H26O12 (458.1424)


cis-p-Coumaric acid 4-[apiosyl-(1->2)-glucoside] is found in herbs and spices. cis-p-Coumaric acid 4-[apiosyl-(1->2)-glucoside] is a constituent of Salvia officinalis (sage). Constituent of Salvia officinalis (sage). cis-p-Coumaric acid 4-[apiosyl-(1->2)-glucoside] is found in tea and herbs and spices.

   

12-Hydroxynevirapine glucuronide

(2S,3S,4S,5R)-3,4,5-trihydroxy-6-{[2-(2-hydroxycyclopropyl)-7-methyl-2,4,9,15-tetraazatricyclo[9.4.0.0³,⁸]pentadeca-1(11),3,5,7,9,12,14-heptaen-10-yl]oxy}oxane-2-carboxylic acid

C21H22N4O8 (458.1438)


12-Hydroxynevirapine glucuronide is a metabolite of nevirapine. Nevirapine, also marketed under the trade name Viramune, is a non-nucleoside reverse transcriptase inhibitor (NNRTI) used to treat HIV-1 infection and AIDS. As with other antiretroviral drugs, HIV rapidly develops resistance if nevirapine is used alone, so recommended therapy consists of combinations of three or more antiretrovirals. (Wikipedia)

   

2-Hydroxynevirapine glucuronide

(2S,3S,4S,5R,6S)-6-({2-cyclopropyl-10-hydroxy-7-methyl-2,4,9,15-tetraazatricyclo[9.4.0.0³,⁸]pentadeca-1(11),3(8),4,6,9,12,14-heptaen-5-yl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

C21H22N4O8 (458.1438)


2-Hydroxynevirapine glucuronide is a metabolite of nevirapine. Nevirapine, also marketed under the trade name Viramune, is a non-nucleoside reverse transcriptase inhibitor (NNRTI) used to treat HIV-1 infection and AIDS. As with other antiretroviral drugs, HIV rapidly develops resistance if nevirapine is used alone, so recommended therapy consists of combinations of three or more antiretrovirals. (Wikipedia)

   

3-Hydroxynevirapine glucuronide

(2S,3S,4S,5R)-6-({2-cyclopropyl-6-hydroxy-7-methyl-2,4,9,15-tetraazatricyclo[9.4.0.0³,⁸]pentadeca-1(11),3,5,7,9,12,14-heptaen-10-yl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

C21H22N4O8 (458.1438)


3-Hydroxynevirapine glucuronide is a metabolite of nevirapine. Nevirapine, also marketed under the trade name Viramune, is a non-nucleoside reverse transcriptase inhibitor (NNRTI) used to treat HIV-1 infection and AIDS. As with other antiretroviral drugs, HIV rapidly develops resistance if nevirapine is used alone, so recommended therapy consists of combinations of three or more antiretrovirals. (Wikipedia)

   

8-Hydroxynevirapine glucuronide

(2R,3R,4R,5S,6R)-6-({2-cyclopropyl-7-methyl-10-oxo-2,4,9,15-tetraazatricyclo[9.4.0.0³,⁸]pentadeca-1(11),3(8),4,6,12,14-hexaen-13-yl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid

C21H22N4O8 (458.1438)


8-Hydroxynevirapine glucuronide is a metabolite of nevirapine. Nevirapine, also marketed under the trade name Viramune, is a non-nucleoside reverse transcriptase inhibitor (NNRTI) used to treat HIV-1 infection and AIDS. As with other antiretroviral drugs, HIV rapidly develops resistance if nevirapine is used alone, so recommended therapy consists of combinations of three or more antiretrovirals. (Wikipedia)

   

12-Chloroisoplagiochin D

12-Chloroisoplagiochin D

C28H23ClO4 (458.1285)


   
   

Ganbajunin F

Ganbajunin F

C27H22O7 (458.1365)


   

Ganbajunin G

Ganbajunin G

C27H22O7 (458.1365)


   
   

alpha-D-Glcp-(1->4)-6-O-(1-L-maloyl)-alpha/beta-D-Glcp|veracylglucan B

alpha-D-Glcp-(1->4)-6-O-(1-L-maloyl)-alpha/beta-D-Glcp|veracylglucan B

C16H26O15 (458.1272)


   

(Z)-1-O-p-Coumaroyl-beta-D-xylopyranosyl-(1->6)-beta-D-glucopyranose

(Z)-1-O-p-Coumaroyl-beta-D-xylopyranosyl-(1->6)-beta-D-glucopyranose

C20H26O12 (458.1424)


   

<2-O-(trans-feruloyl)-alpha-L-arabinofuranosyl>-(1->5)-L-arabinofuranose|O-(2-O-trans-feruloyl-alpha-L-arabinofuranosyl)-(1<*>5)-alpha-L-arabinofuranose|O-(2-O-trans-feruloyl-alpha-L-arabinofuranosyl)-(1[*]5)-alpha-L-arabinofuranose|O-[2-O-(trans-feruloyl)-alpha-L-arabinofuranosyl]-(1-5)-L-arabinofuranose

<2-O-(trans-feruloyl)-alpha-L-arabinofuranosyl>-(1->5)-L-arabinofuranose|O-(2-O-trans-feruloyl-alpha-L-arabinofuranosyl)-(1<*>5)-alpha-L-arabinofuranose|O-(2-O-trans-feruloyl-alpha-L-arabinofuranosyl)-(1[*]5)-alpha-L-arabinofuranose|O-[2-O-(trans-feruloyl)-alpha-L-arabinofuranosyl]-(1-5)-L-arabinofuranose

C20H26O12 (458.1424)


   

22-alpha-D-Glucuronopyranosylxylobiose

22-alpha-D-Glucuronopyranosylxylobiose

C16H26O15 (458.1272)


   

rhaposerin|rhaposerine

rhaposerin|rhaposerine

C21H27ClO9 (458.1344)


   

2-O-<5-O-(trans-feruloyl)-beta-L-arabinofuranosyl>-D-xylopyranose|2-O-[5-O-(trans-feruloyl)-beta-L-arabinofuranosyl]-D-xylopyranose

2-O-<5-O-(trans-feruloyl)-beta-L-arabinofuranosyl>-D-xylopyranose|2-O-[5-O-(trans-feruloyl)-beta-L-arabinofuranosyl]-D-xylopyranose

C20H26O12 (458.1424)


   
   

methyl 3-O-beta-D-glucopyranosyl-6?-O-caffeoyl-(3R)-4-hydroxybutanoate

methyl 3-O-beta-D-glucopyranosyl-6?-O-caffeoyl-(3R)-4-hydroxybutanoate

C20H26O12 (458.1424)


   

(6-cis-p-coumaroyl)-3-O-beta-D-glucopyranosyl-2-deoxy-D-ribonic acid

(6-cis-p-coumaroyl)-3-O-beta-D-glucopyranosyl-2-deoxy-D-ribonic acid

C20H26O12 (458.1424)


   

Interruptin G

Interruptin G

C27H22O7 (458.1365)


   

glucofuraneol tetraacetate

glucofuraneol tetraacetate

C20H26O12 (458.1424)


   

5-O-[(E)-feruloyl]-O-[beta-D-xylopyranosyl-(1->2)]-L-arabinofuranose|beta-D-xylopyranosyl-(1->2)-5-O-trans-feruloyl-L-arabinofuranose

5-O-[(E)-feruloyl]-O-[beta-D-xylopyranosyl-(1->2)]-L-arabinofuranose|beta-D-xylopyranosyl-(1->2)-5-O-trans-feruloyl-L-arabinofuranose

C20H26O12 (458.1424)


   
   

17-dihydro-17-hydroxy-18-chlorovernonataloide

17-dihydro-17-hydroxy-18-chlorovernonataloide

C21H27ClO9 (458.1344)


   

Ala Cys Cys Tyr

(2S)-2-[(2R)-2-[(2R)-2-[(2S)-2-aminopropanamido]-3-sulfanylpropanamido]-3-sulfanylpropanamido]-3-(4-hydroxyphenyl)propanoic acid

C18H26N4O6S2 (458.1294)


   

Ala Cys Tyr Cys

(2R)-2-[(2S)-2-[(2R)-2-[(2S)-2-aminopropanamido]-3-sulfanylpropanamido]-3-(4-hydroxyphenyl)propanamido]-3-sulfanylpropanoic acid

C18H26N4O6S2 (458.1294)


   

Ala Tyr Cys Cys

(2R)-2-[(2R)-2-[(2S)-2-[(2S)-2-aminopropanamido]-3-(4-hydroxyphenyl)propanamido]-3-sulfanylpropanamido]-3-sulfanylpropanoic acid

C18H26N4O6S2 (458.1294)


   

Cys Ala Cys Tyr

(2S)-2-[(2R)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]propanamido]-3-sulfanylpropanamido]-3-(4-hydroxyphenyl)propanoic acid

C18H26N4O6S2 (458.1294)


   

Cys Ala Tyr Cys

(2R)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]propanamido]-3-(4-hydroxyphenyl)propanamido]-3-sulfanylpropanoic acid

C18H26N4O6S2 (458.1294)


   

Cys Cys Ala Tyr

(2S)-2-[(2S)-2-[(2R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-sulfanylpropanamido]propanamido]-3-(4-hydroxyphenyl)propanoic acid

C18H26N4O6S2 (458.1294)


   

Cys Cys Phe Ser

(2S)-2-[(2S)-2-[(2R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-sulfanylpropanamido]-3-phenylpropanamido]-3-hydroxypropanoic acid

C18H26N4O6S2 (458.1294)


   

Cys Cys His Pro

(2S)-1-[(2S)-2-[(2R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-sulfanylpropanamido]-3-(1H-imidazol-4-yl)propanoyl]pyrrolidine-2-carboxylic acid

C17H26N6O5S2 (458.1406)


   

Cys Cys Pro His

(2S)-2-{[(2S)-1-[(2R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-sulfanylpropanoyl]pyrrolidin-2-yl]formamido}-3-(1H-imidazol-4-yl)propanoic acid

C17H26N6O5S2 (458.1406)


   

Cys Cys Ser Phe

(2S)-2-[(2S)-2-[(2R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-sulfanylpropanamido]-3-hydroxypropanamido]-3-phenylpropanoic acid

C18H26N4O6S2 (458.1294)


   

Cys Cys Tyr Ala

(2S)-2-[(2S)-2-[(2R)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-sulfanylpropanamido]-3-(4-hydroxyphenyl)propanamido]propanoic acid

C18H26N4O6S2 (458.1294)


   

Cys Phe Cys Ser

(2S)-2-[(2R)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-phenylpropanamido]-3-sulfanylpropanamido]-3-hydroxypropanoic acid

C18H26N4O6S2 (458.1294)


   

Cys Phe Ser Cys

(2R)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-phenylpropanamido]-3-hydroxypropanamido]-3-sulfanylpropanoic acid

C18H26N4O6S2 (458.1294)


   

Cys His Cys Pro

(2S)-1-[(2R)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-(1H-imidazol-4-yl)propanamido]-3-sulfanylpropanoyl]pyrrolidine-2-carboxylic acid

C17H26N6O5S2 (458.1406)


   

Cys His Pro Cys

(2R)-2-{[(2S)-1-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-(1H-imidazol-4-yl)propanoyl]pyrrolidin-2-yl]formamido}-3-sulfanylpropanoic acid

C17H26N6O5S2 (458.1406)


   

Cys Pro Cys His

(2S)-2-[(2R)-2-{[(2S)-1-[(2R)-2-amino-3-sulfanylpropanoyl]pyrrolidin-2-yl]formamido}-3-sulfanylpropanamido]-3-(1H-imidazol-4-yl)propanoic acid

C17H26N6O5S2 (458.1406)


   

Cys Pro His Cys

(2R)-2-[(2S)-2-{[(2S)-1-[(2R)-2-amino-3-sulfanylpropanoyl]pyrrolidin-2-yl]formamido}-3-(1H-imidazol-4-yl)propanamido]-3-sulfanylpropanoic acid

C17H26N6O5S2 (458.1406)


   

Cys Ser Cys Phe

(2S)-2-[(2R)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-hydroxypropanamido]-3-sulfanylpropanamido]-3-phenylpropanoic acid

C18H26N4O6S2 (458.1294)


   

Cys Ser Phe Cys

(2R)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-hydroxypropanamido]-3-phenylpropanamido]-3-sulfanylpropanoic acid

C18H26N4O6S2 (458.1294)


   

Cys Tyr Ala Cys

(2R)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-(4-hydroxyphenyl)propanamido]propanamido]-3-sulfanylpropanoic acid

C18H26N4O6S2 (458.1294)


   

Cys Tyr Cys Ala

(2S)-2-[(2R)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-(4-hydroxyphenyl)propanamido]-3-sulfanylpropanamido]propanoic acid

C18H26N4O6S2 (458.1294)


   

Phe Cys Cys Ser

(2S)-2-[(2R)-2-[(2R)-2-[(2S)-2-amino-3-phenylpropanamido]-3-sulfanylpropanamido]-3-sulfanylpropanamido]-3-hydroxypropanoic acid

C18H26N4O6S2 (458.1294)


   

Phe Cys Ser Cys

(2R)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-phenylpropanamido]-3-sulfanylpropanamido]-3-hydroxypropanamido]-3-sulfanylpropanoic acid

C18H26N4O6S2 (458.1294)


   

Phe Ser Cys Cys

(2R)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-3-hydroxypropanamido]-3-sulfanylpropanamido]-3-sulfanylpropanoic acid

C18H26N4O6S2 (458.1294)


   

His Cys Cys Pro

(2S)-1-[(2R)-2-[(2R)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-sulfanylpropanamido]-3-sulfanylpropanoyl]pyrrolidine-2-carboxylic acid

C17H26N6O5S2 (458.1406)


   

His Cys Pro Cys

(2R)-2-{[(2S)-1-[(2R)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-sulfanylpropanoyl]pyrrolidin-2-yl]formamido}-3-sulfanylpropanoic acid

C17H26N6O5S2 (458.1406)


   

His Pro Cys Cys

(2R)-2-[(2R)-2-{[(2S)-1-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanoyl]pyrrolidin-2-yl]formamido}-3-sulfanylpropanamido]-3-sulfanylpropanoic acid

C17H26N6O5S2 (458.1406)


   

Pro Cys Cys His

(2S)-3-(1H-imidazol-4-yl)-2-[(2R)-2-[(2R)-2-[(2S)-pyrrolidin-2-ylformamido]-3-sulfanylpropanamido]-3-sulfanylpropanamido]propanoic acid

C17H26N6O5S2 (458.1406)


   

Pro Cys His Cys

(2R)-2-[(2S)-3-(1H-imidazol-4-yl)-2-[(2R)-2-[(2S)-pyrrolidin-2-ylformamido]-3-sulfanylpropanamido]propanamido]-3-sulfanylpropanoic acid

C17H26N6O5S2 (458.1406)


   

Pro His Cys Cys

(2R)-2-[(2R)-2-[(2S)-3-(1H-imidazol-4-yl)-2-[(2S)-pyrrolidin-2-ylformamido]propanamido]-3-sulfanylpropanamido]-3-sulfanylpropanoic acid

C17H26N6O5S2 (458.1406)


   

Ser Cys Cys Phe

(2S)-2-[(2R)-2-[(2R)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-sulfanylpropanamido]-3-sulfanylpropanamido]-3-phenylpropanoic acid

C18H26N4O6S2 (458.1294)


   

Ser Cys Phe Cys

(2R)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-sulfanylpropanamido]-3-phenylpropanamido]-3-sulfanylpropanoic acid

C18H26N4O6S2 (458.1294)


   

Ser Phe Cys Cys

(2R)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-hydroxypropanamido]-3-phenylpropanamido]-3-sulfanylpropanamido]-3-sulfanylpropanoic acid

C18H26N4O6S2 (458.1294)


   

Tyr Ala Cys Cys

(2R)-2-[(2R)-2-[(2S)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]propanamido]-3-sulfanylpropanamido]-3-sulfanylpropanoic acid

C18H26N4O6S2 (458.1294)


   

Tyr Cys Ala Cys

(2R)-2-[(2S)-2-[(2R)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-sulfanylpropanamido]propanamido]-3-sulfanylpropanoic acid

C18H26N4O6S2 (458.1294)


   

Tyr Cys Cys Ala

(2S)-2-[(2R)-2-[(2R)-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]-3-sulfanylpropanamido]-3-sulfanylpropanamido]propanoic acid

C18H26N4O6S2 (458.1294)


   

2'-(E)-Feruloyl-3-(arabinosylxylose)

4-hydroxy-5-(hydroxymethyl)-2-[(2,3,5-trihydroxyoxan-4-yl)oxy]oxolan-3-yl (2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

C20H26O12 (458.1424)


   

cis-p-Coumaric acid 4-[apiosyl-(1->2)-glucoside]

(2E)-3-{4-[(3-{[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy]phenyl}prop-2-enoic acid

C20H26O12 (458.1424)


   

7-Hydroxy-4-methylphthalide O-[arabinosyl-(1->6)-glucoside]

4-methyl-7-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl)oxy]-1,3-dihydro-2-benzofuran-1-one

C20H26O12 (458.1424)


   

Ethanaminium, N, N,N-triethyl-, (T-4)-tetrachloronickelate(2-) (2:1)

Ethanaminium, N, N,N-triethyl-, (T-4)-tetrachloronickelate(2-) (2:1)

C16H40Cl4N2Ni (458.1299)


   

[bis(4-amino-3,5-dimethylphenyl)-(2,6-dichlorophenyl)methoxy]boronic acid

[bis(4-amino-3,5-dimethylphenyl)-(2,6-dichlorophenyl)methoxy]boronic acid

C23H25BCl2N2O3 (458.1335)


   

1-(PERFLUOROHEXYL)DEC-1-ENE

1-(PERFLUOROHEXYL)DEC-1-ENE

C16H19F13 (458.1279)


   

2-[[4-[(2-cyanoethyl)ethylamino]phenyl]azo]-5-[(4-nitrophenyl)azo]thiophene-3-carbonitrile

2-[[4-[(2-cyanoethyl)ethylamino]phenyl]azo]-5-[(4-nitrophenyl)azo]thiophene-3-carbonitrile

C22H18N8O2S (458.1273)


   

POLY(STYRENE-CO-VINYLBENZYL CHLORIDE-CO-DIVINYLBENZENE)

POLY(STYRENE-CO-VINYLBENZYL CHLORIDE-CO-DIVINYLBENZENE)

C27H29Cl3 (458.1335)


   

ethylene glycol bis[4-(2-fluorobenzoyl)phenyl] ether

ethylene glycol bis[4-(2-fluorobenzoyl)phenyl] ether

C28H20F2O4 (458.133)


   

8-Hydroxynevirapine glucuronide

8-Hydroxynevirapine glucuronide

C21H22N4O8 (458.1438)


   

3-Deoxyoctulosonic acid disaccharide

3-Deoxyoctulosonic acid disaccharide

C16H26O15 (458.1272)


   

N-[2-[4-(2-methoxyphenyl)-1-piperazinyl]-2-(3-pyridinyl)ethyl]-2-thiophenesulfonamide

N-[2-[4-(2-methoxyphenyl)-1-piperazinyl]-2-(3-pyridinyl)ethyl]-2-thiophenesulfonamide

C22H26N4O3S2 (458.1446)


   

(1S,4aS,11R,12R,12aR)-3-carbamoyl-1-(dimethylazaniumyl)-4a,7,11,12-tetrahydroxy-11-methyl-4,5,6-trioxo-1,4,4a,5,6,11,12,12a-octahydrotetracen-2-olate

(1S,4aS,11R,12R,12aR)-3-carbamoyl-1-(dimethylazaniumyl)-4a,7,11,12-tetrahydroxy-11-methyl-4,5,6-trioxo-1,4,4a,5,6,11,12,12a-octahydrotetracen-2-olate

C22H22N2O9 (458.1325)


   

2-Hydroxynevirapine glucuronide

2-Hydroxynevirapine glucuronide

C21H22N4O8 (458.1438)


   

3-deoxy-8-O-(3-deoxy-alpha-D-manno-oct-2-ulopyranonosyl)-alpha-D-manno-oct-2-ulopyranosonic acid

3-deoxy-8-O-(3-deoxy-alpha-D-manno-oct-2-ulopyranonosyl)-alpha-D-manno-oct-2-ulopyranosonic acid

C16H26O15 (458.1272)


   

N-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-[2-[2-(4-morpholinyl)-2-oxoethyl]-1-benzimidazolyl]acetamide

N-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-[2-[2-(4-morpholinyl)-2-oxoethyl]-1-benzimidazolyl]acetamide

C22H20F2N4O5 (458.1402)


   

1-[2,5-Dimethyl-1-(2-oxolanylmethyl)-3-pyrrolyl]-2-[[5-(4-methoxyanilino)-1,3,4-thiadiazol-2-yl]thio]ethanone

1-[2,5-Dimethyl-1-(2-oxolanylmethyl)-3-pyrrolyl]-2-[[5-(4-methoxyanilino)-1,3,4-thiadiazol-2-yl]thio]ethanone

C22H26N4O3S2 (458.1446)


   

N-[(2S,3R,6R)-6-[2-[(3,5-dichlorobenzoyl)amino]ethyl]-2-(hydroxymethyl)oxan-3-yl]oxane-4-carboxamide

N-[(2S,3R,6R)-6-[2-[(3,5-dichlorobenzoyl)amino]ethyl]-2-(hydroxymethyl)oxan-3-yl]oxane-4-carboxamide

C21H28Cl2N2O5 (458.1375)


   

N-[(2R,3R,6S)-6-[2-[(3,5-dichlorobenzoyl)amino]ethyl]-2-(hydroxymethyl)oxan-3-yl]oxane-4-carboxamide

N-[(2R,3R,6S)-6-[2-[(3,5-dichlorobenzoyl)amino]ethyl]-2-(hydroxymethyl)oxan-3-yl]oxane-4-carboxamide

C21H28Cl2N2O5 (458.1375)


   

N-[(2S,3R,6S)-6-[2-[[(3,5-dichlorophenyl)-oxomethyl]amino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-4-oxanecarboxamide

N-[(2S,3R,6S)-6-[2-[[(3,5-dichlorophenyl)-oxomethyl]amino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-4-oxanecarboxamide

C21H28Cl2N2O5 (458.1375)


   

N-[(2R,3S,6R)-6-[2-[[(3,5-dichlorophenyl)-oxomethyl]amino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-4-oxanecarboxamide

N-[(2R,3S,6R)-6-[2-[[(3,5-dichlorophenyl)-oxomethyl]amino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-4-oxanecarboxamide

C21H28Cl2N2O5 (458.1375)


   

N-[(2R,3R,6R)-6-[2-[[(3,5-dichlorophenyl)-oxomethyl]amino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-4-oxanecarboxamide

N-[(2R,3R,6R)-6-[2-[[(3,5-dichlorophenyl)-oxomethyl]amino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-4-oxanecarboxamide

C21H28Cl2N2O5 (458.1375)


   

N-[(2R,3S,6S)-6-[2-[(3,5-dichlorobenzoyl)amino]ethyl]-2-(hydroxymethyl)oxan-3-yl]oxane-4-carboxamide

N-[(2R,3S,6S)-6-[2-[(3,5-dichlorobenzoyl)amino]ethyl]-2-(hydroxymethyl)oxan-3-yl]oxane-4-carboxamide

C21H28Cl2N2O5 (458.1375)


   

N-[(2S,3S,6R)-6-[2-[[(3,5-dichlorophenyl)-oxomethyl]amino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-4-oxanecarboxamide

N-[(2S,3S,6R)-6-[2-[[(3,5-dichlorophenyl)-oxomethyl]amino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-4-oxanecarboxamide

C21H28Cl2N2O5 (458.1375)


   

N-[(2S,3S,6S)-6-[2-[[(3,5-dichlorophenyl)-oxomethyl]amino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-4-oxanecarboxamide

N-[(2S,3S,6S)-6-[2-[[(3,5-dichlorophenyl)-oxomethyl]amino]ethyl]-2-(hydroxymethyl)-3-oxanyl]-4-oxanecarboxamide

C21H28Cl2N2O5 (458.1375)


   

3-Hydroxynevirapine glucuronide

3-Hydroxynevirapine glucuronide

C21H22N4O8 (458.1438)


   

2-(E)-Feruloyl-3-(arabinosylxylose)

2-(E)-Feruloyl-3-(arabinosylxylose)

C20H26O12 (458.1424)


   

5a,11a-dehydrooxytetracycline zwitterion

5a,11a-dehydrooxytetracycline zwitterion

C22H22N2O9 (458.1325)


A zwitterion obtained by transfer of a proton from the 2-hydroxy group to the adjacent tertiary amino group of 5a,11a-dehydrooxytetracycline; major species at pH 7.3.

   

3,4',5-trihydroxy-4-(4-hydroxyphenyl)-6-methoxy-[1,1'-biphenyl]-2-yl 2-phenylacetate

3,4',5-trihydroxy-4-(4-hydroxyphenyl)-6-methoxy-[1,1'-biphenyl]-2-yl 2-phenylacetate

C27H22O7 (458.1365)


   

1-O-p-coumaroyl-β-D-xylopyranosyl-(1→6)-β-D-glucopyraboside

NA

C20H26O12 (458.1424)


{"Ingredient_id": "HBIN002928","Ingredient_name": "1-O-p-coumaroyl-\u03b2-D-xylopyranosyl-(1\u21926)-\u03b2-D-glucopyraboside","Alias": "NA","Ingredient_formula": "C20H26O12","Ingredient_Smile": "C1C(C(C(C(O1)OCC2C(C(C(C(O2)OC(=O)C=CC3=CC=C(C=C3)O)O)O)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "37115","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

7-(2,4-dihydroxy-6-methylphenyl)-2,4,6,9-tetrahydroxy-12,12-dimethyltetracen-5-one

7-(2,4-dihydroxy-6-methylphenyl)-2,4,6,9-tetrahydroxy-12,12-dimethyltetracen-5-one

C27H22O7 (458.1365)


   

3-hydroxy-4-oxo-4-[(4,5,6-trihydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)methoxy]butanoic acid

3-hydroxy-4-oxo-4-[(4,5,6-trihydroxy-3-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl)methoxy]butanoic acid

C16H26O15 (458.1272)


   

4-methyl-7-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-3h-2-benzofuran-1-one

4-methyl-7-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-3h-2-benzofuran-1-one

C20H26O12 (458.1424)


   

17-chloropentacyclo[20.2.2.1¹⁰,¹⁴.1¹⁵,¹⁹.0²,⁷]octacosa-1(25),2,4,6,10,12,14(28),15(27),16,18,22(26),23-dodecaene-5,13,16,24-tetrol

17-chloropentacyclo[20.2.2.1¹⁰,¹⁴.1¹⁵,¹⁹.0²,⁷]octacosa-1(25),2,4,6,10,12,14(28),15(27),16,18,22(26),23-dodecaene-5,13,16,24-tetrol

C28H23ClO4 (458.1285)


   

(3ar,4s,6ar,8s,9r,9as,9bs)-9-[(acetyloxy)methyl]-8,9-dihydroxy-3,6-dimethylidene-2-oxo-octahydroazuleno[4,5-b]furan-4-yl (2s)-3-chloro-2-hydroxy-2-methylpropanoate

(3ar,4s,6ar,8s,9r,9as,9bs)-9-[(acetyloxy)methyl]-8,9-dihydroxy-3,6-dimethylidene-2-oxo-octahydroazuleno[4,5-b]furan-4-yl (2s)-3-chloro-2-hydroxy-2-methylpropanoate

C21H27ClO9 (458.1344)


   

(2e)-3-(4-{[(2s,3r,4s,5s,6r)-3-{[(2s,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoic acid

(2e)-3-(4-{[(2s,3r,4s,5s,6r)-3-{[(2s,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoic acid

C20H26O12 (458.1424)


   

11-benzyl-5,11-dihydroxy-6-methyl-4-phenyl-8h,9h-[1,4]dioxocino[5,6-h]chromene-2,12-dione

11-benzyl-5,11-dihydroxy-6-methyl-4-phenyl-8h,9h-[1,4]dioxocino[5,6-h]chromene-2,12-dione

C27H22O7 (458.1365)


   

4-chloropentacyclo[20.2.2.1¹⁰,¹⁴.1¹⁵,¹⁹.0²,⁷]octacosa-1(25),2(7),3,5,10,12,14(28),15(27),16,18,22(26),23-dodecaene-5,13,16,24-tetrol

4-chloropentacyclo[20.2.2.1¹⁰,¹⁴.1¹⁵,¹⁹.0²,⁷]octacosa-1(25),2(7),3,5,10,12,14(28),15(27),16,18,22(26),23-dodecaene-5,13,16,24-tetrol

C28H23ClO4 (458.1285)


   

(11s)-11-benzyl-5,11-dihydroxy-6-methyl-4-phenyl-8h,9h-[1,4]dioxocino[5,6-h]chromene-2,12-dione

(11s)-11-benzyl-5,11-dihydroxy-6-methyl-4-phenyl-8h,9h-[1,4]dioxocino[5,6-h]chromene-2,12-dione

C27H22O7 (458.1365)


   

(1r,2e,8s,10r,11s)-6-[(acetyloxy)methyl]-11-hydroxy-1,10-dimethyl-5-oxo-4,14-dioxatricyclo[9.2.1.0³,⁷]tetradeca-2,6-dien-8-yl (2s)-3-chloro-2-hydroxy-2-methylpropanoate

(1r,2e,8s,10r,11s)-6-[(acetyloxy)methyl]-11-hydroxy-1,10-dimethyl-5-oxo-4,14-dioxatricyclo[9.2.1.0³,⁷]tetradeca-2,6-dien-8-yl (2s)-3-chloro-2-hydroxy-2-methylpropanoate

C21H27ClO9 (458.1344)


   

(3s)-3-hydroxy-4-oxo-4-{[(2r,3s,4r,5r,6s)-4,5,6-trihydroxy-3-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]methoxy}butanoic acid

(3s)-3-hydroxy-4-oxo-4-{[(2r,3s,4r,5r,6s)-4,5,6-trihydroxy-3-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}oxan-2-yl]methoxy}butanoic acid

C16H26O15 (458.1272)


   

2,4',5-trihydroxy-4-(4-hydroxyphenyl)-6-methoxy-[1,1'-biphenyl]-3-yl 2-phenylacetate

2,4',5-trihydroxy-4-(4-hydroxyphenyl)-6-methoxy-[1,1'-biphenyl]-3-yl 2-phenylacetate

C27H22O7 (458.1365)


   

(2z)-3-(4-{[(2s,3r,4s,5s,6r)-3-{[(2s,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoic acid

(2z)-3-(4-{[(2s,3r,4s,5s,6r)-3-{[(2s,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)prop-2-enoic acid

C20H26O12 (458.1424)


   

3-{4-[(3-{[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy]phenyl}prop-2-enoic acid

3-{4-[(3-{[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl)oxy]phenyl}prop-2-enoic acid

C20H26O12 (458.1424)


   

9-[(acetyloxy)methyl]-8,9-dihydroxy-3,6-dimethylidene-2-oxo-octahydroazuleno[4,5-b]furan-4-yl 3-chloro-2-hydroxy-2-methylpropanoate

9-[(acetyloxy)methyl]-8,9-dihydroxy-3,6-dimethylidene-2-oxo-octahydroazuleno[4,5-b]furan-4-yl 3-chloro-2-hydroxy-2-methylpropanoate

C21H27ClO9 (458.1344)