Exact Mass: 648.2471536
Exact Mass Matches: 648.2471536
Found 178 metabolites which its exact mass value is equals to given mass value 648.2471536
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
3-(Hydroxy)phthioceranyl-2-palmitoyl(stearoyl)-2-O-sulfo-alpha,alpha-trehalose
Chalcomoracin
Chalcomoracin is found in fruits. Phytoalexin from diseased white mulberry (Morus alba
2H-3,9a-Methano-1-benzoxepin-4,5,6,7,9,10-hexol, 5a-[(acetyloxy)methyl]octahydro-2,2,9-trimethyl-, 4,6,7,10-tetraacetate-5-benzoate, [3R-(3.alpha.,4.alpha.,5.alpha.,5a.alpha.,6.alpha.,7.alpha.,9.beta.,9a.alpha.,10R*)]-
Embigenin 2-(2-acetylrhamnoside)
[(1S,6S,7R,10R,15S,16R,18S,19R,20R)-6-(3-Furyl)-8,9,18,19,20-pentahydroxy-3-(1-hydroxy-2-methylpropylidene)-7,12,15,17-tetramethyl-4-oxo-5,11,13,21-tetraoxaheptacyclo[10.8.1.114,17.01,10.02,7.010,15.014,19]docos-16-yl]acetic acid
6-O-beta-D-Glycopyranosyl,hexa-Ac-4,12-Tetradecadiene-8,10-diyne-1,6,7-triol,
tasumatrol E
A taxane diterpenoid isolated from Taxus sumatrana and has been shown to exhibit antineoplastic activity.
3,23-disulfate ester of 3beta,19alpha,23-trihydroxyurs-12-en-28-oic acid|3,23-disulfate ester of rotundic acid
(1R,2S,4S,5S,6R,7R,8S,9S,10S)-1,2,8-triacetoxy-9-benzoyloxy-15-(2-methylbutyroyloxy)-4,6-dihydroxydihydro-beta-agarofuran|1alpha,2alpha,8beta-triacetoxy-9alpha-benzoyloxy-15(2)-methylbutyroyloxy-4beta,6beta-dihydroxy-dihydro-beta-agarofuran
10-O-acetylpatrinoside-aglycone-11-O-[alpha-L-rhamnopyranosyl-(1->2)-beta-D-ribohexo-3-ulopyranoside]
<1S-<1alpha(4R*,5S*),3alpha,4beta,5alpha,6alpha(2E,4R*,6R*),7beta>>-1-(4-hydroxy-5-methyl-3-methylene-6-phenylhexyl)-4,6,7-trihydroxy-2,8-dioxabicyclo<3.2.1>octane-3,4,5-tricarboxylic acid, 6-(4,6-dimethyl-2-octenoate)|squalestatin 2
(23epsilon)-1-O-cinnamoyl-17-defurano-17-(4-methoxy-2-buten-4-olide-2-yl)salannic acid methyl ester
(1R,2S,4S,5S,6R,7R,8S,9S,10S)-1,6,8-triacetoxy-9-benzoyloxy-15-(2-methylbutyroyloxy)-2,4-dihydroxydihydro-beta-agarofuran
(2)-4-hydroxy-3-methoxyphenyl beta-D-{6-O-[4-O-(7S,8R)-(4-hydroxy-3-methoxyphenylglycerol-8-yl)-3-methoxybenzoyl]}glucopyranoside
CHALCOMORACIN
3-(7-methoxy-2-(3,4-methylenedioxyphenyl)benzofuran-5-yl)propyl 3-(7-methoxy-2-(3,4-methylenedioxyphenyl)benzofuran-5-yl)propanoate|3-[7-methoxy-2-(3,4-methylenedioxyphenyl)benzofuran-5-yl]propyl 3-[7-methoxy-2-(3,4-methylenedioxyphenyl)benzofuran-5-yl]propanoate
3,23-disulfate ester of 29-hydroxyhederagenin|3,23-disulfate ester of 3beta,23,29-trihydroxyolean-12-en-28-oic acid
patrinoside-aglycone-11-O-[4-O-acetyl-alpha-L-rhamnopyranosyl-(1->2)-beta-D-ribohexo-3-ulopyranoside]
Odoracin
Yuanhuacin is a natural product found in Lasiosiphon kraussianus and Daphne genkwa with data available.
3,5,7,15-tetraacetoxy-2-hydroxy-8-tigloyloxy-9,14-dioxojatropha-6(17),11E-diene
[6-[(5,7-dihydroxy-4-methyl-1,2,3,4-tetrahydronaphthalen-2-yl)oxy]-4,5-dihydroxy-3-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxyoxan-2-yl]methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate
Glu Glu Trp Trp
Glu Trp Glu Trp
Glu Trp Trp Glu
Trp Glu Glu Trp
Trp Glu Trp Glu
Trp Trp Glu Glu
Caylin-2
9H-Carbazole, 9,9-(9H-fluoren-9-ylidenedi-3,1-phenylene)bis-
N-[3,5-bis(trifluoroMethyl)phenyl]-N-[(1S,2S)-2-[(11bR)-3,5-dihydro-4H-dinaphth[2,1-c:1,2-e]azepin-4-yl]cyclohexyl]-Urea
N-[3,5-bis(trifluoroMethyl)phenyl]-N-[(1R,2R)-2-[(11bR)-3,5-dihydro-4H-dinaphth[2,1-c:1,2-e]azepin-4-yl]cyclohexyl]-Urea
2-[5-[3,3-Dimethyl-1-(4-sulfobutyl)-1,3-dihydroindol-2-ylidene]penta-1,3-dienyl]-3,3-dimethyl-1-(4-sulfobutyl)-3H-indolium inner salt sodium salt
Sorocenol H
A member of the class of 1-benzofurans isolated from Sorocea muriculata that has been shown to exhibit antibacterial activity against methicillin-resistant Staphylococcus aureus.
Physostigmine sulphate
C471 - Enzyme Inhibitor > C47792 - Acetylcholinesterase Inhibitor
alpha-D-abequosyl-(1->3)-2-O-methyl-alpha-D-mannosyl-(1->3)-alpha-D-glucosyl-(1->4)-beta-D-glucose
1-[(2R,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-(1-naphthalenyl)urea
C36H39F3N4O4 (648.2923249999999)
1-[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]methyl]-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-3-(1-naphthalenyl)urea
C36H39F3N4O4 (648.2923249999999)
6-[2-[4,5-Dihydroxy-6-methyl-2-[(3,4,5,6-tetrahydroxyoxan-2-yl)methoxy]oxan-3-yl]oxy-4,5-dihydroxy-6-methyloxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
6-[6-[4,5-Dihydroxy-6-methyl-2-[(3,4,5,6-tetrahydroxyoxan-2-yl)methoxy]oxan-3-yl]oxy-4,5-dihydroxy-2-methyloxan-3-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
6-({2-[({4,5-Dihydroxy-6-methyl-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)methyl]-3,5,6-trihydroxyoxan-4-yl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
(2S,4S,5R,6R)-2-[(2R,3S,4S,5R,6S)-3,5-Dihydroxy-2-(hydroxymethyl)-6-[(2R,3S,4R,5R,6R)-4,5,6-trihydroxy-2-(hydroxymethyl)oxan-3-yl]oxyoxan-4-yl]oxy-4-hydroxy-5-[(2-hydroxyacetyl)amino]-6-[(1R,2R)-1,2,3-trihydroxypropyl]oxane-2-carboxamide
3,4,5-Trihydroxy-6-({4-hydroxy-2-methyl-6-[(3,4,5,6-tetrahydroxyoxan-2-yl)methoxy]-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-3-yl}oxy)oxane-2-carboxylic acid
3,4,5-Trihydroxy-6-({3-hydroxy-2-methyl-6-[(3,4,5,6-tetrahydroxyoxan-2-yl)methoxy]-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-4-yl}oxy)oxane-2-carboxylic acid
6-[2-[4,5-Dihydroxy-6-methyl-2-[(3,4,5,6-tetrahydroxyoxan-2-yl)methoxy]oxan-3-yl]oxy-3,5-dihydroxy-6-methyloxan-4-yl]oxy-3,4,5-trihydroxyoxane-2-carboxylic acid
6-({2-[({4,5-Dihydroxy-6-methyl-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)methyl]-4,5,6-trihydroxyoxan-3-yl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
6-({6-[({4,5-Dihydroxy-6-methyl-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl}oxy)methyl]-2,4,5-trihydroxyoxan-3-yl}oxy)-3,4,5-trihydroxyoxane-2-carboxylic acid
[6-[(5,7-dihydroxy-4-methyl-1,2,3,4-tetrahydronaphthalen-2-yl)oxy]-4,5-dihydroxy-3-[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxyoxan-2-yl]methyl (E)-3-(4-hydroxyphenyl)prop-2-enoate
[1-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxy-3-propanoyloxypropan-2-yl] (6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoate
[1-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxy-3-pentanoyloxypropan-2-yl] (4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoate
[(2R,5R,6E,10R,13aS)-1,3a,11,13-tetraacetyloxy-2-hydroxy-2,5,8,8-tetramethyl-12-methylidene-4,9-dioxo-3,5,10,11,13,13a-hexahydro-1H-cyclopenta[12]annulen-10-yl] (E)-2-methylbut-2-enoate
[(2R,5R,6E,10R,13S,13aS)-1,3a,11,13-tetraacetyloxy-2-hydroxy-2,5,8,8-tetramethyl-12-methylidene-4,9-dioxo-3,5,10,11,13,13a-hexahydro-1H-cyclopenta[12]annulen-10-yl] (E)-2-methylbut-2-enoate
(1r,2r,4r,6s,8r,11r,12s,13r,16r,17r,19s,20r)-17,19-bis(acetyloxy)-8-(furan-3-yl)-4-hydroxy-1,9,11,16-tetramethyl-5,14-dioxapentacyclo[11.6.1.0²,¹¹.0⁶,¹⁰.0¹⁶,²⁰]icos-9-en-12-yl benzoate
(1r,2r,6s,7s,8r,10s,11s,12r,14s,16s,17r,18r)-14-[(1e)-hept-1-en-1-yl]-6,7-dihydroxy-8-(hydroxymethyl)-4,18-dimethyl-5-oxo-16-(prop-1-en-2-yl)-9,13,15,19-tetraoxahexacyclo[12.4.1.0¹,¹¹.0²,⁶.0⁸,¹⁰.0¹²,¹⁶]nonadec-3-en-17-yl (2e)-3-phenylprop-2-enoate
1-(3,5-dimethyl-6-phenylhex-3-en-1-yl)-4,7-dihydroxy-6-[(4-hydroxy-4,6-dimethyloct-2-enoyl)oxy]-2,8-dioxabicyclo[3.2.1]octane-3,4,5-tricarboxylic acid
5,8,12-tris(acetyloxy)-2,4-dihydroxy-2,10,10-trimethyl-6-{[(2-methylbutanoyl)oxy]methyl}-11-oxatricyclo[7.2.1.0¹,⁶]dodecan-7-yl benzoate
7-[(acetyloxy)methyl]-6-hydroxy-4-({[5-hydroxy-6-(hydroxymethyl)-4-oxo-3-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl]oxy}methyl)-1h,4ah,5h,6h,7h,7ah-cyclopenta[c]pyran-1-yl 3-methylbutanoate
(3s,4s)-5-[(3s,4s)-4-(acetyloxy)-7,10-dihydroxy-9-methoxy-3-methyl-1h,3h,4h-naphtho[2,3-c]pyran-5-yl]-10-hydroxy-7,9-dimethoxy-3-methyl-1h,3h,4h-naphtho[2,3-c]pyran-4-yl acetate
2-({4,5-dihydroxy-2-[5-hydroxy-7-methoxy-2-(4-methoxyphenyl)-4-oxochromen-6-yl]-6-(hydroxymethyl)oxan-3-yl}oxy)-4,5-dihydroxy-6-methyloxan-3-yl acetate
5-(6-bromohexa-3,5-dien-1-yl)-1,7-dihydroxy-13-[(3-hydroxy-4,5-dimethoxy-6-methyloxan-2-yl)oxy]-5,8,12-trimethyl-4,15-dioxabicyclo[9.3.1]pentadecan-3-one
(2r,4ar,6as,6br,8ar,9r,10s,12ar,12br,14bs)-2-(hydroxymethyl)-2,6a,6b,9,12a-pentamethyl-10-(sulfooxy)-9-[(sulfooxy)methyl]-1,3,4,5,6,7,8,8a,10,11,12,12b,13,14b-tetradecahydropicene-4a-carboxylic acid
(1r,2r,4r,5s,6r,7r,8s,9s,12s)-4,5,8,12-tetrakis(acetyloxy)-6-[(acetyloxy)methyl]-2-hydroxy-2,10,10-trimethyl-11-oxatricyclo[7.2.1.0¹,⁶]dodecan-7-yl benzoate
methyl 3-(acetyloxy)-3-[3,8-bis(acetyloxy)-11-(furan-3-yl)-5-(2-hydroxypropan-2-yl)-2,6,10-trimethyl-13-oxo-12,15-dioxatetracyclo[8.5.0.0¹,¹⁴.0²,⁷]pentadecan-6-yl]propanoate
(1s,3s,4s,5r,6r,7r)-1-[(3e)-3,5-dimethyl-6-phenylhex-3-en-1-yl]-4,7-dihydroxy-6-{[(2e)-4-hydroxy-4,6-dimethyloct-2-enoyl]oxy}-2,8-dioxabicyclo[3.2.1]octane-3,4,5-tricarboxylic acid
13,17,18,30-tetramethoxy-24-methyl-9,11,15,32-tetraoxa-4,24-diazaoctacyclo[31.2.2.1³,⁷.1²⁷,³¹.0⁸,¹².0¹⁶,²¹.0²⁰,²⁵.0¹⁴,³⁹]nonatriaconta-1(35),3,5,7,12,14(39),16(21),17,19,27,29,31(38),33,36-tetradecaene
1-hydroxy-1,2,6a,6b,9,12a-hexamethyl-10-(sulfooxy)-9-[(sulfooxy)methyl]-2,3,4,5,6,7,8,8a,10,11,12,12b,13,14b-tetradecahydropicene-4a-carboxylic acid
(1r,2s,6s,7s,8r,10s,11r,12r,14s,16s,17r,18r)-6,7-dihydroxy-8-(hydroxymethyl)-4,18-dimethyl-14-[(1e,3e)-nona-1,3-dien-1-yl]-5-oxo-16-(prop-1-en-2-yl)-9,13,15,19-tetraoxahexacyclo[12.4.1.0¹,¹¹.0²,⁶.0⁸,¹⁰.0¹²,¹⁶]nonadec-3-en-17-yl benzoate
1α,2α,6β,8β,13-pentaacetoxy-9β-benzoyloxy-4β-hydroxy-β-dihydroagarofuran
{"Ingredient_id": "HBIN002268","Ingredient_name": "1\u03b1,2\u03b1,6\u03b2,8\u03b2,13-pentaacetoxy-9\u03b2-benzoyloxy-4\u03b2-hydroxy-\u03b2-dihydroagarofuran","Alias": "NA","Ingredient_formula": "C32H40O14","Ingredient_Smile": "CC(=O)OCC12C(C(CC(C13C(C(C(C2OC(=O)C4=CC=CC=C4)OC(=O)C)C(O3)(C)C)OC(=O)C)(C)O)OC(=O)C)OC(=O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "16804","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}