Exact Mass: 806.3891

Exact Mass Matches: 806.3891

Found 51 metabolites which its exact mass value is equals to given mass value 806.3891, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Licoricesaponin C2

(2S,3S,4S,5R,6R)-6-{[(3S,6aR,6bS,8aS,11S,14bS)-11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,14a,14b-octadecahydropicen-3-yl]oxy}-5-{[(2R,3R,4S,5S,6S)-6-carboxy-3,4,5-trihydroxyoxan-2-yl]oxy}-3,4-dihydroxyoxane-2-carboxylic acid

C42H62O15 (806.4089)


Licoricesaponin C2 is found in herbs and spices. Licoricesaponin C2 is isolated from roots of Glycyrrhiza uralensis (Chinese licorice). Isolated from roots of Glycyrrhiza uralensis (Chinese licorice). Licoricesaponin C2 is found in herbs and spices.

   

Cyclo(Pro-Phe-D-Trp-Lys-Thr-Phe)

9-(4-aminobutyl)-3,15-dibenzyl-12-(1-hydroxyethyl)-6-(1H-indol-3-ylmethyl)-tetradecahydropyrrolo[1,2-a]1,4,7,10,13,16-hexaazacyclooctadecane-1,4,7,10,13,16-hexone

C44H54N8O7 (806.4115)


   

Colocynthoside B

Colocynthoside B

C42H62O15 (806.4089)


   
   

Certonardoside B

Certonardoside B

C39H66O15S (806.4122)


   

lanosta-1,11,22-triene-3beta,9alpha-diol-18-al-21(24)-lido-3beta-D-glucopyranosyl-(1-4)-beta-D-glucopyranoside|orizalanasterolide B

lanosta-1,11,22-triene-3beta,9alpha-diol-18-al-21(24)-lido-3beta-D-glucopyranosyl-(1-4)-beta-D-glucopyranoside|orizalanasterolide B

C42H62O15 (806.4089)


   
   

ergophilone B

ergophilone B

C49H58O10 (806.403)


   

14,15-didehydrocyclovinblastine

14,15-didehydrocyclovinblastine

C46H54N4O9 (806.3891)


   

cyclovinblastine A

cyclovinblastine A

C46H54N4O9 (806.3891)


   
   

Licoricesaponin C2

5-[(6-carboxy-3,4,5-trihydroxyoxan-2-yl)oxy]-6-[(11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,14a,14b-octadecahydropicen-3-yl)oxy]-3,4-dihydroxyoxane-2-carboxylic acid

C42H62O15 (806.4089)


   

Me glycoside,pentabenzyl-4-O-alpha-D-Mannopyranosyl-D-mannose

Me glycoside,pentabenzyl-4-O-alpha-D-Mannopyranosyl-D-mannose

C48H54O11 (806.3666)


   

Me glycoside 2,3,4,4,6-pentabenzyl-6-O-alpha-D-Mannopyranosyl-D-mannose

Me glycoside 2,3,4,4,6-pentabenzyl-6-O-alpha-D-Mannopyranosyl-D-mannose

C48H54O11 (806.3666)


   

OKODA-PI

1-(9Z-octadecenoyl)-2-(9,12-dioxo-10E-dodecenoyl)-sn-glycero-3-phospho-(1-myo-inositol)

C39H67O15P (806.4217)


   

Birinapant

Birinapant

C42H56F2N8O6 (806.4291)


C274 - Antineoplastic Agent > C129839 - Apoptotic Pathway-targeting Antineoplastic Agent

   

(2S,3S,4S,5R,6R)-6-[(2S,3R,4S,5S,6S)-2-[[(3S,4aR,6aR,6bS,8aS,11S,14aR,14bS)-11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,14a-dodecahydropicen-3-yl]oxy]-6-carboxy-4,5-dihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid

(2S,3S,4S,5R,6R)-6-[(2S,3R,4S,5S,6S)-2-[[(3S,4aR,6aR,6bS,8aS,11S,14aR,14bS)-11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,14a-dodecahydropicen-3-yl]oxy]-6-carboxy-4,5-dihydroxyoxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid

C42H62O15 (806.4089)


   

Smgdg O-18:5_16:4

Smgdg O-18:5_16:4

C43H66O12S (806.4275)


   

Smgdg O-16:4_18:5

Smgdg O-16:4_18:5

C43H66O12S (806.4275)


   

[1-[(4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoxy]-3-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxypropan-2-yl] (3Z,6Z,9Z,12Z,15Z)-octadeca-3,6,9,12,15-pentaenoate

[1-[(4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoxy]-3-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxypropan-2-yl] (3Z,6Z,9Z,12Z,15Z)-octadeca-3,6,9,12,15-pentaenoate

C43H67O12P (806.437)


   

[1-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxy-3-[(3Z,6Z,9Z,12Z,15Z)-octadeca-3,6,9,12,15-pentaenoxy]propan-2-yl] (4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoate

[1-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxy-3-[(3Z,6Z,9Z,12Z,15Z)-octadeca-3,6,9,12,15-pentaenoxy]propan-2-yl] (4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoate

C43H67O12P (806.437)


   

[6-[3-[(7Z,10Z,13Z)-hexadeca-7,10,13-trienoyl]oxy-2-[(3Z,6Z,9Z,12Z,15Z)-octadeca-3,6,9,12,15-pentaenoyl]oxypropoxy]-3,4,5-trihydroxyoxan-2-yl]methanesulfonic acid

[6-[3-[(7Z,10Z,13Z)-hexadeca-7,10,13-trienoyl]oxy-2-[(3Z,6Z,9Z,12Z,15Z)-octadeca-3,6,9,12,15-pentaenoyl]oxypropoxy]-3,4,5-trihydroxyoxan-2-yl]methanesulfonic acid

C43H66O12S (806.4275)


   

[6-[3-[(4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoyl]oxy-2-[(6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoyl]oxypropoxy]-3,4,5-trihydroxyoxan-2-yl]methanesulfonic acid

[6-[3-[(4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoyl]oxy-2-[(6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoyl]oxypropoxy]-3,4,5-trihydroxyoxan-2-yl]methanesulfonic acid

C43H66O12S (806.4275)


   

[(2S,3S,6S)-6-[2-[(5E,7E,9E,11E,13E)-hexadeca-5,7,9,11,13-pentaenoyl]oxy-3-[(11E,13E,15E)-octadeca-11,13,15-trienoyl]oxypropoxy]-3,4,5-trihydroxyoxan-2-yl]methanesulfonic acid

[(2S,3S,6S)-6-[2-[(5E,7E,9E,11E,13E)-hexadeca-5,7,9,11,13-pentaenoyl]oxy-3-[(11E,13E,15E)-octadeca-11,13,15-trienoyl]oxypropoxy]-3,4,5-trihydroxyoxan-2-yl]methanesulfonic acid

C43H66O12S (806.4275)


   

[(2S,3S,6S)-6-[2-[(9E,11E,13E)-hexadeca-9,11,13-trienoyl]oxy-3-[(7E,9E,11E,13E,15E)-octadeca-7,9,11,13,15-pentaenoyl]oxypropoxy]-3,4,5-trihydroxyoxan-2-yl]methanesulfonic acid

[(2S,3S,6S)-6-[2-[(9E,11E,13E)-hexadeca-9,11,13-trienoyl]oxy-3-[(7E,9E,11E,13E,15E)-octadeca-7,9,11,13,15-pentaenoyl]oxypropoxy]-3,4,5-trihydroxyoxan-2-yl]methanesulfonic acid

C43H66O12S (806.4275)


   

[(2S,3S,6S)-6-[2-[(7E,9E,11E,13E)-hexadeca-7,9,11,13-tetraenoyl]oxy-3-[(9E,11E,13E,15E)-octadeca-9,11,13,15-tetraenoyl]oxypropoxy]-3,4,5-trihydroxyoxan-2-yl]methanesulfonic acid

[(2S,3S,6S)-6-[2-[(7E,9E,11E,13E)-hexadeca-7,9,11,13-tetraenoyl]oxy-3-[(9E,11E,13E,15E)-octadeca-9,11,13,15-tetraenoyl]oxypropoxy]-3,4,5-trihydroxyoxan-2-yl]methanesulfonic acid

C43H66O12S (806.4275)


   
   
   
   
   
   

PI P-18:1/12:3;O3

PI P-18:1/12:3;O3

C39H67O15P (806.4217)


   

PI 18:1/12:3;O2

PI 18:1/12:3;O2

C39H67O15P (806.4217)


   

PI 18:2/11:3;O3

PI 18:2/11:3;O3

C38H63O16P (806.3854)


   

PI 18:2/12:2;O2

PI 18:2/12:2;O2

C39H67O15P (806.4217)


   
   
   
   
   

(1r,2r,5s,9s,10r,11r,12r,14r,15r)-10-[(7r)-7-(2,4-dihydroxy-6-methylbenzoyloxy)-7-methyl-6,8-dioxoisochromen-3-yl]-14-[(2r,3e,5r)-5,6-dimethylhept-3-en-2-yl]-5-hydroxy-2,15-dimethylpentacyclo[10.5.2.0²,⁷.0⁹,¹⁸.0¹⁵,¹⁹]nonadeca-7,18-diene-11-carboxylic acid

(1r,2r,5s,9s,10r,11r,12r,14r,15r)-10-[(7r)-7-(2,4-dihydroxy-6-methylbenzoyloxy)-7-methyl-6,8-dioxoisochromen-3-yl]-14-[(2r,3e,5r)-5,6-dimethylhept-3-en-2-yl]-5-hydroxy-2,15-dimethylpentacyclo[10.5.2.0²,⁷.0⁹,¹⁸.0¹⁵,¹⁹]nonadeca-7,18-diene-11-carboxylic acid

C49H58O10 (806.403)


   

(2r)-4-{[(1r,5s)-5-amino-1-{[(1r)-1-{[(1s)-1-carboxyethyl]-c-hydroxycarbonimidoyl}ethyl]-c-hydroxycarbonimidoyl}-5-(c-hydroxycarbonimidoyl)pentyl]-c-hydroxycarbonimidoyl}-2-{[(2r)-1-hydroxy-2-{[(2s)-1-hydroxy-2-{[(2r,3s,4r,5r)-4,5,6-trihydroxy-2-[(1-hydroxyethylidene)amino]-1-oxohexan-3-yl]oxy}propylidene]amino}propylidene]amino}butanoic acid

(2r)-4-{[(1r,5s)-5-amino-1-{[(1r)-1-{[(1s)-1-carboxyethyl]-c-hydroxycarbonimidoyl}ethyl]-c-hydroxycarbonimidoyl}-5-(c-hydroxycarbonimidoyl)pentyl]-c-hydroxycarbonimidoyl}-2-{[(2r)-1-hydroxy-2-{[(2s)-1-hydroxy-2-{[(2r,3s,4r,5r)-4,5,6-trihydroxy-2-[(1-hydroxyethylidene)amino]-1-oxohexan-3-yl]oxy}propylidene]amino}propylidene]amino}butanoic acid

C32H54N8O16 (806.3658)


   

methyl (2r,5r,6s,8s,9s,10r)-14-[(1r,9s,12r,13z,18r)-13-ethylidene-4-methoxy-18-(methoxycarbonyl)-6,8-dimethyl-8,15-diazapentacyclo[10.5.1.0¹,⁹.0²,⁷.0⁹,¹⁵]octadeca-2,4,6-trien-5-yl]-15-methoxy-6,18-dimethyl-3-(2-methylpropanoyl)-7-oxa-3,18-diazapentacyclo[9.7.0.0²,⁸.0⁵,⁹.0¹²,¹⁷]octadeca-1(11),12,14,16-tetraene-10-carboxylate

methyl (2r,5r,6s,8s,9s,10r)-14-[(1r,9s,12r,13z,18r)-13-ethylidene-4-methoxy-18-(methoxycarbonyl)-6,8-dimethyl-8,15-diazapentacyclo[10.5.1.0¹,⁹.0²,⁷.0⁹,¹⁵]octadeca-2,4,6-trien-5-yl]-15-methoxy-6,18-dimethyl-3-(2-methylpropanoyl)-7-oxa-3,18-diazapentacyclo[9.7.0.0²,⁸.0⁵,⁹.0¹²,¹⁷]octadeca-1(11),12,14,16-tetraene-10-carboxylate

C47H58N4O8 (806.4254)


   

16-{[4,5-dihydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]oxy}-8-hydroxy-6-(3-hydroxy-2-methylprop-1-en-1-yl)-2,8,10,13,18,18-hexamethyl-5-oxapentacyclo[11.8.0.0²,¹⁰.0⁴,⁹.0¹⁴,¹⁹]henicosa-15,19-diene-12,17-dione

16-{[4,5-dihydroxy-6-(hydroxymethyl)-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]oxy}-8-hydroxy-6-(3-hydroxy-2-methylprop-1-en-1-yl)-2,8,10,13,18,18-hexamethyl-5-oxapentacyclo[11.8.0.0²,¹⁰.0⁴,⁹.0¹⁴,¹⁹]henicosa-15,19-diene-12,17-dione

C42H62O15 (806.4089)


   

(2s,3s,4s,5r,6r)-6-{[(3s,4ar,6ar,6bs,8as,11s,14ar,14bs)-11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,14a-dodecahydropicen-3-yl]oxy}-5-{[(2r,3r,4s,5s,6s)-6-carboxy-3,4,5-trihydroxyoxan-2-yl]oxy}-3,4-dihydroxyoxane-2-carboxylic acid

(2s,3s,4s,5r,6r)-6-{[(3s,4ar,6ar,6bs,8as,11s,14ar,14bs)-11-carboxy-4,4,6a,6b,8a,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,14a-dodecahydropicen-3-yl]oxy}-5-{[(2r,3r,4s,5s,6s)-6-carboxy-3,4,5-trihydroxyoxan-2-yl]oxy}-3,4-dihydroxyoxane-2-carboxylic acid

C42H62O15 (806.4089)


   

(1r,3s,3ar,4r,5r,6r,7as)-6-[(1s,2r,3r,4s,6s)-4-(acetyloxy)-6-hydroxy-2-(2-methoxy-2-oxoethyl)-1,3-dimethyl-7,9-dioxabicyclo[4.2.1]nonan-3-yl]-5-(formyloxy)-3-(furan-3-yl)-7a-hydroxy-3a-methyl-1-{[(2s)-2-methylbutanoyl]oxy}-7-methylidene-hexahydroinden-4-yl (2r,3r)-2-hydroxy-3-methylpentanoate

(1r,3s,3ar,4r,5r,6r,7as)-6-[(1s,2r,3r,4s,6s)-4-(acetyloxy)-6-hydroxy-2-(2-methoxy-2-oxoethyl)-1,3-dimethyl-7,9-dioxabicyclo[4.2.1]nonan-3-yl]-5-(formyloxy)-3-(furan-3-yl)-7a-hydroxy-3a-methyl-1-{[(2s)-2-methylbutanoyl]oxy}-7-methylidene-hexahydroinden-4-yl (2r,3r)-2-hydroxy-3-methylpentanoate

C41H58O16 (806.3725)


   

[(2r,3s,4r,5r)-2-{[(2r,6r)-6-[(1r,3r,3as,3br,5s,5as,7s,9ar,9bs,11ar)-3,5,7-trihydroxy-9a,11a-dimethyl-tetradecahydro-1h-cyclopenta[a]phenanthren-1-yl]-2-methyl-3-methylideneheptyl]oxy}-3-{[(2s,3r,4s,5r)-4,5-dihydroxy-3-methoxyoxan-2-yl]oxy}-5-hydroxyoxan-4-yl]oxidanesulfonic acid

[(2r,3s,4r,5r)-2-{[(2r,6r)-6-[(1r,3r,3as,3br,5s,5as,7s,9ar,9bs,11ar)-3,5,7-trihydroxy-9a,11a-dimethyl-tetradecahydro-1h-cyclopenta[a]phenanthren-1-yl]-2-methyl-3-methylideneheptyl]oxy}-3-{[(2s,3r,4s,5r)-4,5-dihydroxy-3-methoxyoxan-2-yl]oxy}-5-hydroxyoxan-4-yl]oxidanesulfonic acid

C39H66O15S (806.4122)


   

(1s,2s,4r,6s,8s,9r,10r,13r,14r)-16-{[(2s,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]oxy}-8-hydroxy-6-[(1e)-3-hydroxy-2-methylprop-1-en-1-yl]-2,8,10,13,18,18-hexamethyl-5-oxapentacyclo[11.8.0.0²,¹⁰.0⁴,⁹.0¹⁴,¹⁹]henicosa-15,19-diene-12,17-dione

(1s,2s,4r,6s,8s,9r,10r,13r,14r)-16-{[(2s,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-2-yl]oxy}-8-hydroxy-6-[(1e)-3-hydroxy-2-methylprop-1-en-1-yl]-2,8,10,13,18,18-hexamethyl-5-oxapentacyclo[11.8.0.0²,¹⁰.0⁴,⁹.0¹⁴,¹⁹]henicosa-15,19-diene-12,17-dione

C42H62O15 (806.4089)


   

(2s)-2,9-diamino-6-[amino(c-hydroxycarbonimidoyl)methyl]-9-{[(2r)-1-[(2s)-n-[(1r)-1-carboxyethyl]-2-[(2-{[(2s,3r,4r,5s,6r)-2,5-dihydroxy-3-[(1-hydroxyethylidene)amino]-6-(hydroxymethyl)oxan-4-yl]oxy}-1-hydroxypropylidene)amino]propanamido]-1-oxopropan-2-yl]-c-hydroxycarbonimidoyl}-5-oxononanoic acid

(2s)-2,9-diamino-6-[amino(c-hydroxycarbonimidoyl)methyl]-9-{[(2r)-1-[(2s)-n-[(1r)-1-carboxyethyl]-2-[(2-{[(2s,3r,4r,5s,6r)-2,5-dihydroxy-3-[(1-hydroxyethylidene)amino]-6-(hydroxymethyl)oxan-4-yl]oxy}-1-hydroxypropylidene)amino]propanamido]-1-oxopropan-2-yl]-c-hydroxycarbonimidoyl}-5-oxononanoic acid

C32H54N8O16 (806.3658)


   

6-[4-(acetyloxy)-6-hydroxy-2-(2-methoxy-2-oxoethyl)-1,3-dimethyl-7,9-dioxabicyclo[4.2.1]nonan-3-yl]-5-(formyloxy)-3-(furan-3-yl)-7a-hydroxy-3a-methyl-1-[(2-methylbutanoyl)oxy]-7-methylidene-hexahydroinden-4-yl 2-hydroxy-3-methylpentanoate

6-[4-(acetyloxy)-6-hydroxy-2-(2-methoxy-2-oxoethyl)-1,3-dimethyl-7,9-dioxabicyclo[4.2.1]nonan-3-yl]-5-(formyloxy)-3-(furan-3-yl)-7a-hydroxy-3a-methyl-1-[(2-methylbutanoyl)oxy]-7-methylidene-hexahydroinden-4-yl 2-hydroxy-3-methylpentanoate

C41H58O16 (806.3725)


   

2,9-diamino-6-[amino(c-hydroxycarbonimidoyl)methyl]-9-({1-[n-(1-carboxyethyl)-2-{[2-({2,5-dihydroxy-3-[(1-hydroxyethylidene)amino]-6-(hydroxymethyl)oxan-4-yl}oxy)-1-hydroxypropylidene]amino}propanamido]-1-oxopropan-2-yl}-c-hydroxycarbonimidoyl)-5-oxononanoic acid

2,9-diamino-6-[amino(c-hydroxycarbonimidoyl)methyl]-9-({1-[n-(1-carboxyethyl)-2-{[2-({2,5-dihydroxy-3-[(1-hydroxyethylidene)amino]-6-(hydroxymethyl)oxan-4-yl}oxy)-1-hydroxypropylidene]amino}propanamido]-1-oxopropan-2-yl}-c-hydroxycarbonimidoyl)-5-oxononanoic acid

C32H54N8O16 (806.3658)