Exact Mass: 696.2629224
Exact Mass Matches: 696.2629224
Found 128 metabolites which its exact mass value is equals to given mass value 696.2629224
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Sesamolinol 4'-O-b-D-glucosyl (1->6)-O-b-D-glucoside
Sesamolinol 4-O-b-D-glucosyl (1->6)-O-b-D-glucoside is a polyphenol compound found in foods of plant origin (PMID: 20428313)
2,10,15,20-Tetraphenyl-21,22,23,24-tetrahydroporphyrin-5-sulfonic acid
Tallimustine
Arctigenin 4-O-β-gentiobioside
Arctigenin 4-O-beta-gentiobioside is a natural product found in Trachelospermum asiaticum with data available.
2,4-Dihydroxy-6-methoxy-3-(2-hydroxybenzyl)-5-(3 x 2-hydroxybenzyl)dihydrochalcone
methyl (1S,4aS,7aS)-7-(hydroxymethyl)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxymethyl]oxan-2-yl]oxymethyl]oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate
5-Demethoxy,8-methoxy-2,2,3,3-Tetrahydro-3,3,6,7,7,8-hexamethoxy-4-(4-methoxyphenyl)-4-phenyl-5,6-bi-1H-phenalene,
trans-4,5-dihydroxy-3-methoxystilbene-5-O-{alpha-L-rhamnopyranosyl-(1->2)-[alpha-L-rhamnopyranosyl-(1->6)]}-beta-D-glucopyranoside
<4-(3-beta-D-glucopyranosyloxy-1-Z-propenyl)-2,6-dimethoxyphenyl>-6-O-beta-D-glucopyranosyl-beta-D-glucopyranoside
pinoresinol-4-O-[6-O-(E)-feruloyl]-beta-D-glucopyranoside
2-methoxy-2-(3,4-dihydroxyphenyl)ethyl O-alpha-L-rhamnopyranosyl-(1->3)-2-O-acetyl-4-O-trans-caffeoyl-beta-D-glucopyranoside|kankanoside J1|kankanoside J2
4-O-[(E)-p-coumaroyl]gentiobiosylgenipin|methyl (1S,4aS,7aS)-1,4a,5,7a-tetrahydro-7-(hydroxymethyl)-1-[(6-O-[4-O-[(2E)-3-(4-hydroxyphenyl)prop-2-enoyl]-beta-D-glucopyranosyl]-beta-D-glucopyranosyl)oxy]cyclopenta[c]pyran-4-carboxylate
2,2,3,3-Tetrahydro-3,3,6,7,7,8-hexamethoxy-4-(4-methoxyphenyl)-4-phenyl-5,6-bi[1H-phenalene]
(2S,4R)-5,7-dihydroxy-4,4-dimethoxy-6,8-dimethylflavan-5-O-beta-D-6-acetylglucopyranoside-7-O-beta-D-glucopyranoside
[2-[4-[[4-[(3,4-dimethoxyphenyl)methyl]-2-oxooxolan-3-yl]methyl]-2-methoxyphenoxy]-3,5-dihydroxy-6-(hydroxymethyl)oxan-4-yl] 3-(3,4-dihydroxyphenyl)prop-2-enoate
beta-Phenyl-2,4-dihydroxy-3-[2-hydroxy-5-[2-hydroxy-3-(2-hydroxybenzyl)benzyl]benzyl]-5-(2-hydroxybenzyl)-6-methoxypropiophenone
C32H40O17_Methyl (1S,4aS,7aS)-7-(hydroxymethyl)-1-[(6-O-{6-O-[(2E)-3-(4-hydroxyphenyl)-2-propenoyl]-beta-D-glucopyranosyl}-beta-D-glucopyranosyl)oxy]-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate
C32H40O17_Cyclopenta[c]pyran-4-carboxylic acid, 1,4a,5,7a-tetrahydro-7-(hydroxymethyl)-1-[[6-O-[6-O-[(2Z)-3-(4-hydroxyphenyl)-1-oxo-2-propen-1-yl]-beta-D-glucopyranosyl]-beta-D-glucopyranosyl]oxy]-, methyl ester
methyl (1S,4aS,7aS)-7-(hydroxymethyl)-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(2R,3R,4S,5S,6R)-3,4,5-trihydroxy-6-[[(E)-3-(4-hydroxyphenyl)prop-2-enoyl]oxymethyl]oxan-2-yl]oxymethyl]oxan-2-yl]oxy-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate_major
Sesamolinol diglucoside
Methyl (1S,4aS,7aS)-7-(hydroxymethyl)-1-[(6-O-{6-O-[(2E)-3-(4-hydroxyphenyl)-2-propenoyl]-?-D-glucopyranosyl}-?-D-glucopyranosyl)oxy]-1,4a,5,7a-tetrahydrocyclopenta[c]pyran-4-carboxylate
Tallimustine
D000970 - Antineoplastic Agents > D018906 - Antineoplastic Agents, Alkylating > D009588 - Nitrogen Mustard Compounds C274 - Antineoplastic Agent > C186664 - Cytotoxic Chemotherapeutic Agent > C2842 - DNA Binding Agent D000890 - Anti-Infective Agents > D000900 - Anti-Bacterial Agents > D004214 - Distamycins D009676 - Noxae > D000477 - Alkylating Agents
O,O-Bis(diethoxyphosphoryl)calix[4]arene,
C36H42O10P2 (696.2253092000001)
Methyl O-beta-D-glucopyranosyl-(1-4)-S-beta-D-glucopyranosyl-(1-4)-O-4-thio-beta-D-glucopyranosyl-(1-4)-beta-D-glucopyranoside
2,10,15,20-Tetraphenyl-21,22,23,24-tetrahydroporphyrin-5-sulfonic acid
rifamycin SV(1-)
C37H46NO12- (696.3019856000001)
A phenolate anion obtained by deprotonation of the 5-hydroxy group of rifamycin SV. It is the major microspecies at pH 7.3 (according to Marvin v 6.2.0.).
Sesamolinol 4-O-b-D-glucosyl (1->6)-O-b-D-glucoside
[(2r,3s,4s,5r,6r)-3,4,5-trihydroxy-6-{[(2s,3s,4r,5r)-4-hydroxy-2,5-bis(hydroxymethyl)-3-{[(2e)-3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]oxy}oxolan-2-yl]oxy}oxan-2-yl]methyl 4-methoxybenzoate
(1r,2s,3r,6r,8s,9s,13s,14r,15r,16s,17r)-3-{[(2e)-3,4-dimethylpent-2-enoyl]oxy}-15,16-dihydroxy-9,13-dimethyl-4,10-dioxo-11-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-5,18-dioxapentacyclo[12.5.0.0¹,⁶.0²,¹⁷.0⁸,¹³]nonadec-11-ene-17-carboxylic acid
(2s,3r,4r,5s,6s)-4-(acetyloxy)-5-hydroxy-2-{[(1s,2s,4s,5s,6r,10s)-2-(hydroxymethyl)-10-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,9-dioxatricyclo[4.4.0.0²,⁴]dec-7-en-5-yl]oxy}-6-methyloxan-3-yl (2e)-3-(4-hydroxyphenyl)prop-2-enoate
(2r,3r,4s,5r,6r)-5-(acetyloxy)-6-[(2s)-2-(3,4-dihydroxyphenyl)-2-methoxyethoxy]-2-(hydroxymethyl)-4-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-3-yl (2e)-3-(3,4-dihydroxyphenyl)prop-2-enoate
(1r,2r,3s,4r,5s,6s,8s,10s,11r,12r,15s)-3,4,6,11-tetrakis(acetyloxy)-2-hydroxy-1,5,15-trimethyl-9-methylidene-14-oxo-16-oxatetracyclo[10.5.0.0²,¹⁵.0⁵,¹⁰]heptadecan-8-yl (2e)-3-phenylprop-2-enoate
3,4,6,11-tetrakis(acetyloxy)-2-hydroxy-1,5,15-trimethyl-9-methylidene-14-oxo-16-oxatetracyclo[10.5.0.0²,¹⁵.0⁵,¹⁰]heptadecan-8-yl 3-phenylprop-2-enoate
3-[(3,4-dimethylpent-2-enoyl)oxy]-15,16-dihydroxy-9,13-dimethyl-4,10-dioxo-11-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-5,18-dioxapentacyclo[12.5.0.0¹,⁶.0²,¹⁷.0⁸,¹³]nonadec-11-ene-17-carboxylic acid
(2s,3r,4r,5r,6s)-5-(acetyloxy)-4-hydroxy-6-{[(1s,2s,4s,5s,6s,10s)-2-(hydroxymethyl)-10-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,9-dioxatricyclo[4.4.0.0²,⁴]dec-7-en-5-yl]oxy}-2-methyloxan-3-yl (2e)-3-(4-hydroxyphenyl)prop-2-enoate
2-[(3,4-dihydroxy-6-{3-[2-(4-hydroxyphenyl)ethenyl]-5-methoxyphenoxy}-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl)methoxy]-6-methyloxane-3,4,5-triol
(2s,3r,4r,5s,6s)-4-(acetyloxy)-5-hydroxy-2-{[(1s,2s,4s,5s,6r,10s)-2-(hydroxymethyl)-10-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-3,9-dioxatricyclo[4.4.0.0²,⁴]dec-7-en-5-yl]oxy}-6-methyloxan-3-yl (2z)-3-(4-hydroxyphenyl)prop-2-enoate
1-cinnamoyl-11-methoxymeliacarpinin
{"Ingredient_id": "HBIN002448","Ingredient_name": "1-cinnamoyl-11-methoxymeliacarpinin","Alias": "NA","Ingredient_formula": "C37H44O13","Ingredient_Smile": "CC12COC3C1C4(COC(C4C5(C3OC6(C5(C7CC6C8(C=COC8O7)O)O)C)C)(C(=O)OC)OC)C(CC2O)OC(=O)C=CC9=CC=CC=C9","Ingredient_weight": "696.747","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "3710","TCMSP_id": "NA","TCM_ID_id": "9228","PubChem_id": "NA","DrugBank_id": "NA"}
1-Cinnamoyl-3-hydroxy-11-methoxymeliacarpinin
{"Ingredient_id": "HBIN002450","Ingredient_name": "1-Cinnamoyl-3-hydroxy-11-methoxymeliacarpinin","Alias": "1-cinnamoyl-3-hydroxy-11-methoxymeliacarpinin","Ingredient_formula": "C37H44O13","Ingredient_Smile": "CC12COC3C1C4(COC(C4C5(C3OC6(C5(C7CC6C8(C=COC8O7)O)O)C)C)(C(=O)OC)OC)C(CC2O)OC(=O)C=CC9=CC=CC=C9","Ingredient_weight": "696.81","OB_score": "35.71659095","CAS_id": "NA","SymMap_id": "SMIT00909","TCMID_id": "30786","TCMSP_id": "MOL002263","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
6''-o-p-cis-coumaroylgenipin gentiobioside
{"Ingredient_id": "HBIN012704","Ingredient_name": "6''-o-p-cis-coumaroylgenipin gentiobioside","Alias": "NA","Ingredient_formula": "C32H40O17","Ingredient_Smile": "COC(=O)C1=COC(C2C1CC=C2CO)OC3C(C(C(C(O3)COC4C(C(C(C(O4)COC(=O)C=CC5=CC=C(C=C5)O)O)O)O)O)O)O","Ingredient_weight": "696.6 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "NA","TCMSP_id": "NA","TCM_ID_id": "7522","PubChem_id": "102507167","DrugBank_id": "NA"}
6''-o-p-coumaroylgenipingentiobioside
{"Ingredient_id": "HBIN012710","Ingredient_name": "6''-o-p-coumaroylgenipingentiobioside","Alias": "NA","Ingredient_formula": "C32H40O17","Ingredient_Smile": "COC(=O)C1=COC(C2C1CC=C2CO)OC3C(C(C(C(O3)COC4C(C(C(C(O4)COC(=O)C=CC5=CC=C(C=C5)O)O)O)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT14780","TCMID_id": "4160","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
arctigenin 4'-gentiobioside
{"Ingredient_id": "HBIN016611","Ingredient_name": "arctigenin 4'-gentiobioside","Alias": "NA","Ingredient_formula": "C33H44O16","Ingredient_Smile": "COC1=C(C=C(C=C1)CC2COC(=O)C2CC3=CC(=C(C=C3)OC4C(C(C(C(O4)COC5C(C(C(C(O5)CO)O)O)O)O)O)O)OC)OC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1622","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}