Exact Mass: 648.281343
Exact Mass Matches: 648.281343
Found 218 metabolites which its exact mass value is equals to given mass value 648.281343
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
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*)]-
[(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,
(5alpha,6alpha,7alpha,12beta,22R)-5,12-dihydroxy-1,26-dioxo-6,7:22,26-diepoxyergosta-2,24-dien-27-yl beta-D-glucopyranoside|baimantuoluoside A
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
CHALCOMORACIN
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
Glu Glu Trp Trp
Glu Trp Glu Trp
Glu Trp Trp Glu
Trp Glu Glu Trp
Trp Glu Trp Glu
Trp Trp Glu Glu
Evasterioside C
1,3,3-trimethyl-2-((e)-2-(2-(1-naphthyl)-3-[(e)-2-(1,3,3-trimethyl-1,3-dihydro-2h-indol-2-ylidene)ethylidene]-1-cyclopenten-1-yl)ethenyl)-3h-indolium tetrafluoroborate
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
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.
(2R,3R,4R,5R)-3,4-Dihydroxy-N,N-bis[(1S,2R)-2-hydroxy-2,3-dihydro-1H-inden-1-YL]-2,5-bis(2-phenylethyl)hexanediamide
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
L-tryptophylglycyl-L-isoleucyl-L-histidyl-L-histidine
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)
[(E,5R)-2-methyl-5-[(3S,5S,6R,8S,9R,10S,13R,14S,15S,17R)-6,8,15-trihydroxy-10,13-dimethyl-3-[(2S,3S,5R)-3,4,5-trihydroxyoxan-2-yl]oxy-1,2,3,4,5,6,7,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]hex-3-enyl] hydrogen sulfate
[2-hydroxy-3-[hydroxy-(2,3,4,5,6-pentahydroxycyclohexyl)oxyphosphoryl]oxypropyl] (10Z,13Z,16Z,19Z)-docosa-10,13,16,19-tetraenoate
[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
1-(7Z,10Z,13Z,16Z-docosatetraenoyl)-glycero-3-phospho-(1-myo-inositol)
(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
(1s,2s,3ar,5r,9s,10s,11s,13r,13as)-9,10-bis(acetyloxy)-3a,5,13-trihydroxy-2,5,8,8-tetramethyl-11-{[(2z)-2-methylbut-2-enoyl]oxy}-12-methylidene-4-oxo-1h,2h,3h,9h,10h,11h,13h,13ah-cyclopenta[12]annulen-1-yl (2z)-2-methylbut-2-enoate
(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
(1s,2s,4s,5r,10r,11s,13r,14r,15r,18s)-5,13-dihydroxy-10,14-dimethyl-15-[(1s)-1-[(2r)-4-methyl-6-oxo-5-({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-2,3-dihydropyran-2-yl]ethyl]-3-oxapentacyclo[9.7.0.0²,⁴.0⁵,¹⁰.0¹⁴,¹⁸]octadec-7-en-9-one
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
(1s,2s,3s,7s,8s,9r,10s,11s,12z,14s,17r)-2,7,10-tris(acetyloxy)-9-hydroxy-4,8,12,17-tetramethyl-16-oxo-15,18-dioxatetracyclo[12.4.0.0¹,¹⁷.0³,⁸]octadeca-4,12-dien-11-yl octanoate
4-(2-{[(2s,3r,4r)-5-[(1r)-1,2-dihydroxyethyl]-3,4-dihydroxyoxolan-2-yl]oxy}-6-heptyl-4-hydroxybenzoyloxy)-2-heptyl-6-hydroxybenzoic acid
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
4-(2-{[5-(1,2-dihydroxyethyl)-3,4-dihydroxyoxolan-2-yl]oxy}-6-heptyl-4-hydroxybenzoyloxy)-2-heptyl-6-hydroxybenzoic acid
(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
4-[7-(3,7-dimethylocta-2,6-dien-1-yl)-6,8,12-trihydroxy-17,17-dimethyl-5-(3-methylbut-2-en-1-yl)-10,14-dioxo-3,16-dioxapentacyclo[11.4.1.0²,¹¹.0²,¹⁵.0⁴,⁹]octadeca-4,6,8-trien-15-yl]-2-methylbut-2-enoic acid
5-(acetyloxy)-2,4,12-trihydroxy-2,10,10-trimethyl-8-[(2-methylbutanoyl)oxy]-6-{[(2-methylbutanoyl)oxy]methyl}-11-oxatricyclo[7.2.1.0¹,⁶]dodecan-7-yl benzoate
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"}