Exact Mass: 696.2265
Exact Mass Matches: 696.2265
Found 187 metabolites which its exact mass value is equals to given mass value 696.2265,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Licorice glycoside B
Licorice glycoside B is found in herbs and spices. Licorice glycoside B is a constituent of Glycyrrhiza uralensis (Chinese licorice)
Licorice glycoside D1
Licorice glycoside D2 is found in herbs and spices. Licorice glycoside D2 is a constituent of Glycyrrhiza uralensis (Chinese licorice)
Gnemonol A
Gnemonol A is found in green vegetables. Gnemonol A is a constituent of the roots of Gnetum gnemon (bago). Constituent of the roots of Gnetum gnemon (bago). Gnemonol A is found in green vegetables.
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)
Gomphrenin II
Isogomphrenin II is found in brassicas. Isogomphrenin II is a pigment from the fruits of Basella rubra (Malabar spinach).
2,10,15,20-Tetraphenyl-21,22,23,24-tetrahydroporphyrin-5-sulfonic acid
Tallimustine
Apigenin 6-C-arabinosyl-8-C-glucoside
Apigenin 6-c-arabinosyl-8-c-glucoside is slightly soluble (in water) and a very weakly acidic compound (based on its pKa). Apigenin 6-c-arabinosyl-8-c-glucoside can be found in fig, which makes apigenin 6-c-arabinosyl-8-c-glucoside a potential biomarker for the consumption of this food product.
Arctigenin 4-O-β-gentiobioside
Arctigenin 4-O-beta-gentiobioside is a natural product found in Trachelospermum asiaticum with data available.
Kaempferol 3-apiosyl-(1-
isomollupentin 7-O-glucoside-2-O-arabinoside
2,4-Dihydroxy-6-methoxy-3-(2-hydroxybenzyl)-5-(3 x 2-hydroxybenzyl)dihydrochalcone
Haploside C
Isovitexin 7-O-xyloside 2'-O-arabinoside
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
trans-4,5-dihydroxy-3-methoxystilbene-5-O-{alpha-L-rhamnopyranosyl-(1->2)-[alpha-L-rhamnopyranosyl-(1->6)]}-beta-D-glucopyranoside
Kaempferol 3-apiosyl-(1->2)-alpha-L-arabinofuranoside-7-rhamnoside
<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
7-O-[6-O-(5-O-syringoyl-beta-D-apiofuranosyl)-beta-D-glucopyranosyl]-6,8-dimethoxycoumarin|eryciboside F
(2S)-naringenin 7-O-[5-O-trans-cinnamoyl-beta-D-apiosyl(1->2)]-beta-D-glucopyranoside|visartiside C
3-O-beta-(6-acetyl-beta-D-glucopyranosyl)-4-O-(beta-D-glucopyranosyl)rhamnazin|nerilifordin F
kaempferol 3-O-beta-D-xylopyranosyl-(1?2)-alpha-L-arabinofuranosyl-7-O-alpha-L-rhamnopyranoside
3-O-(beta-D-glucopyranosyl)-4-O-(6-O-acetyl-beta-D-glucosyl)rhamnazin|nerilifordin G
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
(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
[(2R,3S,4S,5R,6S)-6-[3,5-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-8-methoxy-4-oxochromen-7-yl]oxy-3,4-dihydroxy-5-[(2S,3R,4R,5R,6S)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxyoxan-2-yl]methyl acetate
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
Isoliquiritigenin 4-O-(5-O-p-coumaroyl)-apiofuranosyl-(1->2)-glucoside
Sesamolinol diglucoside
Licorice glycoside B
Gomphrenin II
Gnemonol A
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
Methyl O-beta-D-glucopyranosyl-(1-4)-S-beta-D-glucopyranosyl-(1-4)-O-4-thio-beta-D-glucopyranosyl-(1-4)-beta-D-glucopyranoside
6-O-P-Coumaroylgenipin gentiobioside
3,5-Dibromo-1,2,4-trimethyl-1,2,4,3,5-triazadiborolidine
2,10,15,20-Tetraphenyl-21,22,23,24-tetrahydroporphyrin-5-sulfonic acid
(20R,23S)-20-[(2R)-butan-2-yl]-16-phenyl-23-propan-2-yl-3,7,15,28-tetraoxa-11-thia-19,22,25,30,31,32,33,34-octazahexacyclo[25.2.1.12,5.16,9.110,13.114,17]tetratriaconta-1(29),2(34),4,6(33),8,10(32),12,14(31),16,27(30)-decaene-18,21,24-trione
Sesamolinol 4-O-b-D-glucosyl (1->6)-O-b-D-glucoside
YM-216391
An azamacrocycle with formula C34H32N8O7S isolated from the cultured mycelium of Streptomyces nobilis. It exhibits potent cytotoxic activity against human cancer cell lines.
[(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
11-(2,4-dihydroxyphenyl)-7-(3,5-dihydroxyphenyl)-6,19-bis(4-hydroxyphenyl)-5,18-dioxapentacyclo[11.6.1.0²,¹⁰.0⁴,⁸.0¹⁷,²⁰]icosa-2(10),3,8,13,15,17(20)-hexaene-9,15-diol
(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
(3r,4r,10r,11r,18s)-18-(2,4-dihydroxyphenyl)-3-(3,5-dihydroxyphenyl)-4,10-bis(4-hydroxyphenyl)-5,9-dioxapentacyclo[9.8.1.0²,⁶.0⁸,²⁰.0¹²,¹⁷]icosa-1,6,8(20),12,14,16-hexaene-14,16-diol
(3s,4r,10r,11r,18r,19r)-3-(3,5-dihydroxyphenyl)-4,10,18-tris(4-hydroxyphenyl)-5,9-dioxapentacyclo[9.8.1.0²,⁶.0⁸,²⁰.0¹²,¹⁷]icosa-1,6,8(20),12,14,16-hexaene-14,16,19-triol
7-{[(2s,3r,4s,5s,6r)-3-{[(2r,3s,4s,5r)-3,4-dihydroxy-5-(hydroxymethyl)oxolan-2-yl]oxy}-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-5-hydroxy-2-(4-hydroxyphenyl)-6-[(2s,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]chromen-4-one
5-[3-(3,5-dihydroxyphenyl)-4-hydroxy-6-[4-hydroxy-2-(4-hydroxyphenyl)-6-[2-(4-hydroxyphenyl)ethenyl]-2,3-dihydro-1-benzofuran-3-yl]-2,3-dihydro-1-benzofuran-2-yl]benzene-1,3-diol
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
23-isopropyl-16-phenyl-20-(sec-butyl)-3,7,15,28-tetraoxa-11-thia-19,22,25,30,31,32,33,34-octaazahexacyclo[25.2.1.1²,⁵.1⁶,⁹.1¹⁰,¹³.1¹⁴,¹⁷]tetratriaconta-1(29),2(34),4,6(33),8,10(32),12,14(31),16,18,21,24,27(30)-tridecaene-18,21,24-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
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"}
