Exact Mass: 648.3509
Exact Mass Matches: 648.3509
Found 59 metabolites which its exact mass value is equals to given mass value 648.3509,
within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error
0.001 dalton.
Proctolin
2-[({1-[2-({2-[(2-amino-5-carbamimidamido-1-hydroxypentylidene)amino]-1-hydroxy-3-(4-hydroxyphenyl)propylidene}amino)-4-methylpentanoyl]pyrrolidin-2-yl}(hydroxy)methylidene)amino]-3-hydroxybutanoate
(1S,2R,3S,3aR,5S,6R,7S,7aS)-2-acetoxy-1-(1-acetoxyethyl)octahydro-3,6-bis[(2-methylbutanoyl)oxy]-4-methylidene-7-[(2S)-2-methyloxyran-2-yl]-1H-inden-5-yl (2E)-3-methylpent-2-enoate
(1S,2R,3S,3aR,5S,6R,7S,7aS)-2-acetoxy-1-(1-acetoxyethyl)octahydro-3,6-bis[(2-methylbutanoyl)oxy]-4-methylidene-7-[(2S)-2-methyloxyran-2-yl]-1H-inden-5-yl (2E)-3-methylpent-2-enoate
2beta,3beta-dihydroxy-30-norolean-12,20(29)-diene-23,28-dioic acid 28-O-beta-D-glucopyranosyl ester
2beta,3beta-dihydroxy-30-norolean-12,20(29)-diene-23,28-dioic acid 28-O-beta-D-glucopyranosyl ester
20-hydroxyecdysone 2,3,22,25-tetraacetate|Crustecdyson-2,3,22,25-tetraacetat (Viticosteron E-2,3,22-triacetat)|ecdysterone 2,3,22,25-tetraacetate|ecdysterone 2beta,3beta,22R,25-tetraacetate|ecdysterone tetraacetate
20-hydroxyecdysone 2,3,22,25-tetraacetate|Crustecdyson-2,3,22,25-tetraacetat (Viticosteron E-2,3,22-triacetat)|ecdysterone 2,3,22,25-tetraacetate|ecdysterone 2beta,3beta,22R,25-tetraacetate|ecdysterone tetraacetate
Cytotrienin A
Cytotrienin A
A 21-membered macrocyclic lactam which contains three conjugated double bonds as part of the ring system. It acts as an apoptosis inducer in human leukemia HL-60 cells and is isolated from Streptomyces sp. D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D012294 - Rifamycins
Proctolin
Proctolin
Proctolin is an endogenous pentapeptide that acts as an excitatory neuromodulator.
2-[(1-{1,4-dihydroxy-8,11-dimethyl-3,7,9-trioxatricyclo[6.3.0.0²,⁶]undecan-5-yl}-9a,11a-dimethyl-1h,2h,4h,5h,5ah,6h,7h,8h,9h,10h,11h-cyclopenta[a]phenanthren-7-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
2-[(1-{1,4-dihydroxy-8,11-dimethyl-3,7,9-trioxatricyclo[6.3.0.0²,⁶]undecan-5-yl}-9a,11a-dimethyl-1h,2h,4h,5h,5ah,6h,7h,8h,9h,10h,11h-cyclopenta[a]phenanthren-7-yl)oxy]-6-(hydroxymethyl)oxane-3,4,5-triol
16β,22r ;21,23s-diepoxy-3β-o-β-d-glucopyra-nosyloxy-21s,24-dihydroxy-5α-stigmasta-8,14-dien-28-one
NA
{"Ingredient_id": "HBIN001818","Ingredient_name": "16\u03b2,22r ;21,23s-diepoxy-3\u03b2-o-\u03b2-d-glucopyra-nosyloxy-21s,24-dihydroxy-5\u03b1-stigmasta-8,14-dien-28-one","Alias": "NA","Ingredient_formula": "C35H52O11","Ingredient_Smile": "CC(C)C(C1C2C(C3C(O2)C=C4C3(CCC5=C4CCC6C5(CCC(C6)OC7C(C(C(C(O7)CO)O)O)O)C)C)C(O1)O)(C(=O)C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5492","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
2-(acetyloxy)-1-[1-(acetyloxy)ethyl]-3,6-bis[(2-methylbutanoyl)oxy]-4-methylidene-7-(2-methyloxiran-2-yl)-octahydroinden-5-yl 3-methylpent-2-enoate
2-(acetyloxy)-1-[1-(acetyloxy)ethyl]-3,6-bis[(2-methylbutanoyl)oxy]-4-methylidene-7-(2-methyloxiran-2-yl)-octahydroinden-5-yl 3-methylpent-2-enoate
(3s,3ar,5r,6r,6as)-3-[(1r,3ar,5as,7s,9as,11ar)-9a,11a-dimethyl-7-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,2h,3h,3ah,5h,5ah,6h,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-5,6-dihydroxy-6-isopropyl-5-methyl-dihydro-3h-furo[3,2-b]furan-2-one
(3s,3ar,5r,6r,6as)-3-[(1r,3ar,5as,7s,9as,11ar)-9a,11a-dimethyl-7-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,2h,3h,3ah,5h,5ah,6h,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-5,6-dihydroxy-6-isopropyl-5-methyl-dihydro-3h-furo[3,2-b]furan-2-one
n-[1-({[(5r,8z,10z,13s,14r,15r,16z)-3,15-dihydroxy-5-methoxy-14,16-dimethyl-22,24-dioxo-2-azabicyclo[18.3.1]tetracosa-1(23),2,6,8,10,16,20-heptaen-13-yl]oxy}carbonyl)cyclopropyl]cyclohexanecarboximidic acid
n-[1-({[(5r,8z,10z,13s,14r,15r,16z)-3,15-dihydroxy-5-methoxy-14,16-dimethyl-22,24-dioxo-2-azabicyclo[18.3.1]tetracosa-1(23),2,6,8,10,16,20-heptaen-13-yl]oxy}carbonyl)cyclopropyl]cyclohexanecarboximidic acid
n-[1-({[(5r,6e,8e,10e,13s,14r,15r,16z)-3,15,22,24-tetrahydroxy-5-methoxy-14,16-dimethyl-2-azabicyclo[18.3.1]tetracosa-1(24),2,6,8,10,16,20,22-octaen-13-yl]oxy}carbonyl)cyclopropyl]cyclohex-1-ene-1-carboximidic acid
n-[1-({[(5r,6e,8e,10e,13s,14r,15r,16z)-3,15,22,24-tetrahydroxy-5-methoxy-14,16-dimethyl-2-azabicyclo[18.3.1]tetracosa-1(24),2,6,8,10,16,20,22-octaen-13-yl]oxy}carbonyl)cyclopropyl]cyclohex-1-ene-1-carboximidic acid
[(1s,3s,3as,3bs,5s,5as,7s,9as,9br,11ar)-5,7-dihydroxy-9a,11a-dimethyl-1-[(2r,5s)-6-methyl-5-{[(2r,3r,4r,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}heptan-2-yl]-tetradecahydro-1h-cyclopenta[a]phenanthren-3-yl]oxidanesulfonic acid
[(1s,3s,3as,3bs,5s,5as,7s,9as,9br,11ar)-5,7-dihydroxy-9a,11a-dimethyl-1-[(2r,5s)-6-methyl-5-{[(2r,3r,4r,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}heptan-2-yl]-tetradecahydro-1h-cyclopenta[a]phenanthren-3-yl]oxidanesulfonic acid
(1r,5r,6r,8r,9s,10r,12s,15s)-8-hydroxy-6-[(2r)-6-hydroxy-6-methyl-4-oxoheptan-2-yl]-5,9,14,14-tetramethyl-15-{[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}-19,20-dioxapentacyclo[10.6.2.0²,¹⁰.0⁵,⁹.0¹³,¹⁸]icosa-2,13(18)-dien-7-one
(1r,5r,6r,8r,9s,10r,12s,15s)-8-hydroxy-6-[(2r)-6-hydroxy-6-methyl-4-oxoheptan-2-yl]-5,9,14,14-tetramethyl-15-{[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]oxy}-19,20-dioxapentacyclo[10.6.2.0²,¹⁰.0⁵,⁹.0¹³,¹⁸]icosa-2,13(18)-dien-7-one
(5r)-3-[(1s,2r,3ar,5as,7s,9as,11as)-2-hydroxy-9a,11a-dimethyl-7-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,2h,3h,3ah,5h,5ah,6h,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-5-[(2s,3r)-2,3-dihydroxy-4-methylpentan-3-yl]-5h-furan-2-one
(5r)-3-[(1s,2r,3ar,5as,7s,9as,11as)-2-hydroxy-9a,11a-dimethyl-7-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,2h,3h,3ah,5h,5ah,6h,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-5-[(2s,3r)-2,3-dihydroxy-4-methylpentan-3-yl]-5h-furan-2-one
n-[1-({[(5r,6e,8e,10z,13s,14s,15r,16e)-3,15-dihydroxy-5-methoxy-14,16-dimethyl-22,24-dioxo-2-azabicyclo[18.3.1]tetracosa-1(23),2,6,8,10,16,20-heptaen-13-yl]oxy}carbonyl)cyclopropyl]cyclohexanecarboximidic acid
n-[1-({[(5r,6e,8e,10z,13s,14s,15r,16e)-3,15-dihydroxy-5-methoxy-14,16-dimethyl-22,24-dioxo-2-azabicyclo[18.3.1]tetracosa-1(23),2,6,8,10,16,20-heptaen-13-yl]oxy}carbonyl)cyclopropyl]cyclohexanecarboximidic acid
(1s,2r,3s,3ar,5s,6r,7s,7as)-2-(acetyloxy)-1-[(1s)-1-(acetyloxy)ethyl]-3,6-bis({[(2r)-2-methylbutanoyl]oxy})-4-methylidene-7-[(2s)-2-methyloxiran-2-yl]-octahydroinden-5-yl (2e)-3-methylpent-2-enoate
(1s,2r,3s,3ar,5s,6r,7s,7as)-2-(acetyloxy)-1-[(1s)-1-(acetyloxy)ethyl]-3,6-bis({[(2r)-2-methylbutanoyl]oxy})-4-methylidene-7-[(2s)-2-methyloxiran-2-yl]-octahydroinden-5-yl (2e)-3-methylpent-2-enoate
(3r)-3-hydroxy-3-[(7s,10s,14r,15r,16s,17s,19s,20r,22s)-17-hydroxy-10,14-dimethyl-7-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-18,21-dioxahexacyclo[12.9.0.0²,¹¹.0⁵,¹⁰.0¹⁵,²².0¹⁶,²⁰]tricosa-1(23),2(11)-dien-19-yl]-4-methylpentan-2-one
(3r)-3-hydroxy-3-[(7s,10s,14r,15r,16s,17s,19s,20r,22s)-17-hydroxy-10,14-dimethyl-7-{[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-18,21-dioxahexacyclo[12.9.0.0²,¹¹.0⁵,¹⁰.0¹⁵,²².0¹⁶,²⁰]tricosa-1(23),2(11)-dien-19-yl]-4-methylpentan-2-one
[(1r,3as,3br,5r,5as,7r,9ar,9bs,11r,11as)-5-hydroxy-1-[(2r)-1-hydroxy-6-methylheptan-2-yl]-9a,11a-dimethyl-11-{[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}-tetradecahydro-1h-cyclopenta[a]phenanthren-7-yl]oxidanesulfonic acid
[(1r,3as,3br,5r,5as,7r,9ar,9bs,11r,11as)-5-hydroxy-1-[(2r)-1-hydroxy-6-methylheptan-2-yl]-9a,11a-dimethyl-11-{[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}-tetradecahydro-1h-cyclopenta[a]phenanthren-7-yl]oxidanesulfonic acid
2,3-dihydroxy-4,6a,6b,14b-tetramethyl-11-methylidene-8a-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}carbonyl)-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4-carboxylic acid
2,3-dihydroxy-4,6a,6b,14b-tetramethyl-11-methylidene-8a-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}carbonyl)-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4-carboxylic acid
(2r,3r,4s,5s,6r)-2-{[(1r,5as,7s,9as,11ar)-1-[(1r,2r,4r,5r,6s,8r,11s)-1,4-dihydroxy-8,11-dimethyl-3,7,9-trioxatricyclo[6.3.0.0²,⁶]undecan-5-yl]-9a,11a-dimethyl-1h,2h,4h,5h,5ah,6h,7h,8h,9h,10h,11h-cyclopenta[a]phenanthren-7-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
(2r,3r,4s,5s,6r)-2-{[(1r,5as,7s,9as,11ar)-1-[(1r,2r,4r,5r,6s,8r,11s)-1,4-dihydroxy-8,11-dimethyl-3,7,9-trioxatricyclo[6.3.0.0²,⁶]undecan-5-yl]-9a,11a-dimethyl-1h,2h,4h,5h,5ah,6h,7h,8h,9h,10h,11h-cyclopenta[a]phenanthren-7-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol
(4s,5s)-5-[(1r)-2-amino-1-hydroxyethyl]-2-{[3-({3-amino-6-[(3,6-diamino-1-hydroxyhexylidene)amino]-1-hydroxyhexylidene}amino)-4,5-dihydroxy-6-[(c-hydroxycarbonimidoyloxy)methyl]oxan-2-yl]amino}-4,5-dihydro-3h-imidazole-4-carboxylic acid
(4s,5s)-5-[(1r)-2-amino-1-hydroxyethyl]-2-{[3-({3-amino-6-[(3,6-diamino-1-hydroxyhexylidene)amino]-1-hydroxyhexylidene}amino)-4,5-dihydroxy-6-[(c-hydroxycarbonimidoyloxy)methyl]oxan-2-yl]amino}-4,5-dihydro-3h-imidazole-4-carboxylic acid
n-[1-({[(8e,10e,16z)-3,15,22,24-tetrahydroxy-5-methoxy-14,16-dimethyl-2-azabicyclo[18.3.1]tetracosa-1(24),2,6,8,10,16,20,22-octaen-13-yl]oxy}carbonyl)cyclopropyl]cyclohex-1-ene-1-carboximidic acid
n-[1-({[(8e,10e,16z)-3,15,22,24-tetrahydroxy-5-methoxy-14,16-dimethyl-2-azabicyclo[18.3.1]tetracosa-1(24),2,6,8,10,16,20,22-octaen-13-yl]oxy}carbonyl)cyclopropyl]cyclohex-1-ene-1-carboximidic acid
[(1r,3s,3as,3br,5s,7s,9ar,9bs,11ar)-5,7-dihydroxy-9a,11a-dimethyl-1-[(2r)-6-methyl-5-{[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}heptan-2-yl]-tetradecahydro-1h-cyclopenta[a]phenanthren-3-yl]oxidanesulfonic acid
[(1r,3s,3as,3br,5s,7s,9ar,9bs,11ar)-5,7-dihydroxy-9a,11a-dimethyl-1-[(2r)-6-methyl-5-{[(2s,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}heptan-2-yl]-tetradecahydro-1h-cyclopenta[a]phenanthren-3-yl]oxidanesulfonic acid
(2s,3s,3as,5ar,5bs,9r,13s,14r,16as,16bs)-3,13-dihydroxy-9-[(1e,3s)-3-hydroxybut-1-en-1-yl]-14-methyl-2-{[(2s,3r,4r,5s,6s)-3,4,5-trimethoxy-6-methyloxan-2-yl]oxy}-1h,2h,3h,3ah,5ah,5bh,6h,9h,10h,11h,12h,13h,14h,16ah,16bh-as-indaceno[3,2-d]oxacyclododecane-7,15-dione
(2s,3s,3as,5ar,5bs,9r,13s,14r,16as,16bs)-3,13-dihydroxy-9-[(1e,3s)-3-hydroxybut-1-en-1-yl]-14-methyl-2-{[(2s,3r,4r,5s,6s)-3,4,5-trimethoxy-6-methyloxan-2-yl]oxy}-1h,2h,3h,3ah,5ah,5bh,6h,9h,10h,11h,12h,13h,14h,16ah,16bh-as-indaceno[3,2-d]oxacyclododecane-7,15-dione
3-(9a,11a-dimethyl-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,2h,3h,3ah,5h,5ah,6h,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl)-5,6-dihydroxy-6-isopropyl-5-methyl-dihydro-3h-furo[3,2-b]furan-2-one
3-(9a,11a-dimethyl-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,2h,3h,3ah,5h,5ah,6h,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl)-5,6-dihydroxy-6-isopropyl-5-methyl-dihydro-3h-furo[3,2-b]furan-2-one
5-(2,3-dihydroxy-4-methylpentan-3-yl)-3-(2-hydroxy-9a,11a-dimethyl-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,2h,3h,3ah,5h,5ah,6h,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl)-5h-furan-2-one
5-(2,3-dihydroxy-4-methylpentan-3-yl)-3-(2-hydroxy-9a,11a-dimethyl-7-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,2h,3h,3ah,5h,5ah,6h,7h,8h,9h,11h-cyclopenta[a]phenanthren-1-yl)-5h-furan-2-one
n-{1-[({3,15-dihydroxy-5-methoxy-14,16-dimethyl-22,24-dioxo-2-azabicyclo[18.3.1]tetracosa-1(23),2,6,8,10,16,20-heptaen-13-yl}oxy)carbonyl]cyclopropyl}cyclohexanecarboximidic acid
n-{1-[({3,15-dihydroxy-5-methoxy-14,16-dimethyl-22,24-dioxo-2-azabicyclo[18.3.1]tetracosa-1(23),2,6,8,10,16,20-heptaen-13-yl}oxy)carbonyl]cyclopropyl}cyclohexanecarboximidic acid
(2s,3r,4s,4ar,6ar,6bs,8as,12as,14ar,14br)-2,3-dihydroxy-4,6a,6b,14b-tetramethyl-11-methylidene-8a-({[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}carbonyl)-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4-carboxylic acid
(2s,3r,4s,4ar,6ar,6bs,8as,12as,14ar,14br)-2,3-dihydroxy-4,6a,6b,14b-tetramethyl-11-methylidene-8a-({[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}carbonyl)-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicene-4-carboxylic acid
3,13-dihydroxy-9-(3-hydroxybut-1-en-1-yl)-14-methyl-2-[(3,4,5-trimethoxy-6-methyloxan-2-yl)oxy]-1h,2h,3h,3ah,5ah,5bh,6h,9h,10h,11h,12h,13h,14h,16ah,16bh-as-indaceno[3,2-d]oxacyclododecane-7,15-dione
3,13-dihydroxy-9-(3-hydroxybut-1-en-1-yl)-14-methyl-2-[(3,4,5-trimethoxy-6-methyloxan-2-yl)oxy]-1h,2h,3h,3ah,5ah,5bh,6h,9h,10h,11h,12h,13h,14h,16ah,16bh-as-indaceno[3,2-d]oxacyclododecane-7,15-dione
(2r,3s,4s,5r)-6-({2-[(1ar,2r,4ar,7r,8ar)-2,7-dihydroxy-4a-methyl-8-methylidene-hexahydronaphtho[1,8a-b]oxiren-2-yl]propan-2-yl}oxy)-2-methyl-5-{[(2z)-2-methylbut-2-enoyl]oxy}-4-[(2-methylpropanoyl)oxy]oxan-3-yl (2z)-2-methylbut-2-enoate
(2r,3s,4s,5r)-6-({2-[(1ar,2r,4ar,7r,8ar)-2,7-dihydroxy-4a-methyl-8-methylidene-hexahydronaphtho[1,8a-b]oxiren-2-yl]propan-2-yl}oxy)-2-methyl-5-{[(2z)-2-methylbut-2-enoyl]oxy}-4-[(2-methylpropanoyl)oxy]oxan-3-yl (2z)-2-methylbut-2-enoate
