Exact Mass: 768.257118
Exact Mass Matches: 768.257118
Found 83 metabolites which its exact mass value is equals to given mass value 768.257118
,
within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error
0.01 dalton.
Tenuifoliside C
Tenuifoliside C is a natural product found in Polygala glomerata, Polygala karensium, and other organisms with data available. Tenuifoliside C, isolated from polygala tenuifolia willd, significantly inhibits chlorzoxazone 6-hydroxylation catalyzed by CYP2E1[1]. Tenuifoliside C, isolated from polygala tenuifolia willd, significantly inhibits chlorzoxazone 6-hydroxylation catalyzed by CYP2E1[1].
Yadanzioside K
15-acetyltrichagmalin E
A limonoid that is the 15-acetyl derivative of trichagmalin E. It has been isolated from Trichilia connaroides.
(S,R,S,R/R,S,R,S)-7-acetoxy-1-<2-acetoxy-1-<4-(3-acetoxyprop-2-enyl)>2-methoxyphenoxy>-3-(4-acetoxy-3-methoxyphenyl)-4-acetoxymethyl-6-methoxy-isochroman
isorhamnetin-3-O-[6-O-rhamnosylgalactoside]-7-O-rhamnoside
Viscumneoside VII
A viscumneoside that is viscumneoside IV in which the hydroxy group at position 2 of the glucosyl moiety has been converted to the corresponding beta-D-apifuranoside derivative. Found in Viscum coloratum, an evergreen hemiparasitic plant whose stems and leaves are used in traditional Chinese medicine for the treatment of rheumatism.
acacetin 7-O-beta-D-glucuronopyranosyl-(1->2)-[alpha-L-rhamnopyranosyl-(1->6)]-beta-D-glucopyranoside
isorhamnetin 3-O-[(S)-3-hydroxy-3-methylglutaroyl(1->6)]-alpha-L-rhamnopyranosyl(1->2)-beta-D-glucopyranoside
oxytroflavoside E|rhamnocitrin-3-O-[(S)-3-hydroxy-3-methylglutaryl-(1->6)]-beta-D-galactopyranoside-4-O-beta-D-glucopyranoside
3-acetylamino-7-(3-acetylamino-7-(N-acetyl-2-aminoethyl)-1,4-benzodioxan-2-yl)-2-(2-(3,4-dihydroxyphenyl)-3-acetylamino-1,4-benzodioxan-7-yl)-1,4-benzodioxane|cicadamide A
3-acetylamino-7-(3-acetylamino-6-(N-acetyl-2-aminoethyl)-1,4-benzodioxan-2-yl)-2-(2-(3,4-dihydroxyphenyl)-3-acetylamino-1,4-benzodioxan-7-yl)-1,4-benzodioxane|cicadamide B
[(2S,3R,4R,5S,6S)-2-[[(1aS,1bS,2S,5aR,6S,6aS)-1a-(hydroxymethyl)-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,5a,6,6a-tetrahydro-1bH-oxireno[5,6]cyclopenta[1,3-c]pyran-6-yl]oxy]-5-hydroxy-6-methyl-3-[(E)-3-phenylprop-2-enoyl]oxyoxan-4-yl] (E)-3-phenylprop-2-enoate
C35H44O19_(1aS,1bS,2S,5aR,6S,6aS)-6-({2,3-Di-O-acetyl-6-deoxy-4-O-[(2E)-3-(3-hydroxy-4-methoxyphenyl)-2-propenoyl]-alpha-L-mannopyranosyl}oxy)-1a-(hydroxymethyl)-1a,1b,2,5a,6,6a-hexahydrooxireno[4,5]cyclopenta[1,2-c]pyran-2-yl beta-D-glucopyranoside
[(2S,3R,4R,5S,6S)-2-[[(1aS,1bS,2S,5aR,6S,6aS)-1a-(hydroxymethyl)-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,5a,6,6a-tetrahydro-1bH-oxireno[5,6]cyclopenta[1,3-c]pyran-6-yl]oxy]-5-hydroxy-6-methyl-3-[(E)-3-phenylprop-2-enoyl]oxyoxan-4-yl] (E)-3-phenylprop-2-enoate [IIN-based: Match]
[(2S,3R,4R,5S,6S)-2-[[(1aS,1bS,2S,5aR,6S,6aS)-1a-(hydroxymethyl)-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,5a,6,6a-tetrahydro-1bH-oxireno[5,6]cyclopenta[1,3-c]pyran-6-yl]oxy]-5-hydroxy-6-methyl-3-[(E)-3-phenylprop-2-enoyl]oxyoxan-4-yl] (E)-3-phenylprop-2-enoate [IIN-based on: CCMSLIB00000846713]
4-[(4-aminophenyl)methyl]aniline,3-[[3-aminopropyl(dimethyl)silyl]oxy-dimethylsilyl]propan-1-amine,5-(1,3-dioxo-2-benzofuran-5-carbonyl)-2-benzofuran-1,3-dione
(R)-2,2,3,3-Tetrahydro-6,6-bis(triphenylsilyl)-1,1-spirobi[1H-indene]-7,7-diol,99\\%e.e.
Halistanol sulfate F
An organic sodium salt that is the trisodium salt of halistanol sulfonic acid F. Isolated from the marine sponge Pseudaxinyssa digitata, it exhibits anti-HIV activity.
(3R)-5-[[(2R,3S,4S,5R,6S)-5-[(2S,3R,4R)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-3,4-dihydroxy-6-[5-hydroxy-2-(4-hydroxy-3-methoxyphenyl)-7-methoxy-4-oxochromen-3-yl]oxyoxan-2-yl]methoxy]-3-hydroxy-3-methyl-5-oxopentanoic acid
1-[(3S,9S,10R)-9-[[(4-chlorophenyl)sulfonyl-methylamino]methyl]-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-3-[4-(trifluoromethyl)phenyl]urea
6-[[2-[4-[3-[4-Acetyloxy-3-hydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-4,5-dihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyphenyl]-4-oxo-2,3-dihydrochromen-7-yl]oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
[(2S,3R,4R,5S,6S)-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-methyl-3-[(E)-3-phenylprop-2-enoyl]oxyoxan-4-yl] (E)-3-phenylprop-2-enoate
(2s,3s,4r,5r,6s)-4,5-bis(acetyloxy)-6-{[(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}-2-methyloxan-3-yl (2e)-3-(3-hydroxy-4-methoxyphenyl)prop-2-enoate
5-hydroxy-6-[2-(3-hydroxy-4-methoxyphenyl)ethoxy]-4-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]-2-[(3,4,5-trihydroxyoxan-2-yl)methyl]oxan-3-yl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
methyl 5-butoxy-1-{[3,5-dihydroxy-6-(hydroxymethyl)-4-{[3,4,5-trihydroxy-6-({[3-(4-hydroxyphenyl)prop-2-enoyl]oxy}methyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-7-(hydroxymethyl)-1h,4ah,5h,7ah-cyclopenta[c]pyran-4-carboxylate
5-({3,4-dihydroxy-5-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl)oxy]-6-{[(3,4,5-trihydroxyoxan-2-yl)oxy]methyl}oxan-2-yl}oxy)-6-(hydroxymethyl)oxane-2,3,4-triol
(3s)-3-hydroxy-3-methyl-5-oxo-5-{[(2r,3r,4s,5r,6s)-3,4,5-trihydroxy-6-{[5-hydroxy-7-methoxy-4-oxo-2-(4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}phenyl)chromen-3-yl]oxy}oxan-2-yl]methoxy}pentanoic acid
methyl (1s,4as,5s,7as)-5-butoxy-1-{[(2s,3r,4s,5r,6r)-3,5-dihydroxy-6-(hydroxymethyl)-4-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2z)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}methyl)oxan-2-yl]oxy}oxan-2-yl]oxy}-7-(hydroxymethyl)-1h,4ah,5h,7ah-cyclopenta[c]pyran-4-carboxylate
(2r,3r,4r,6r)-2-({[(2s,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-6-[2-(3-hydroxy-4-methoxyphenyl)ethoxy]-4-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}oxan-3-yl (2e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
11-chloro-21,23-dihydroxy-12,20-dimethoxy-2,5,16-trimethyl-8-oxo-9-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]-4,24-dioxa-9,22-diazatetracyclo[19.3.1.1¹⁰,¹⁴.0³,⁵]hexacosa-10(26),11,13,16,18,22-hexaen-6-yl propanoate
methyl (2s,3r,6r,13s,15r,17s)-3-{[(2e)-4-(acetyloxy)-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-carboxylate
methyl (1r,2s,6r,13s,15r,17s)-3-{[(2e)-4-(acetyloxy)-3,4-dimethylpent-2-enoyl]oxy}-15,16-dihydroxy-9,13-dimethyl-4,11-dioxo-10-{[(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-9-ene-17-carboxylate
6'''-p-coumaroylspinosin
{"Ingredient_id": "HBIN012752","Ingredient_name": "6'''-p-coumaroylspinosin","Alias": "NA","Ingredient_formula": "C38H40O17","Ingredient_Smile": "CC1=CC2=C(C(=O)C=C(O2)C3=CC=C(C=C3)O)C(=C1C4C(C(C(C(O4)CO)O)O)OC5C(C(C(C(O5)COC(=O)C=CC6=CC(=C(C=C6)O)OC)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "4187","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
methyl (1r,2s,3s,6r,8s,13r,14r,15r,16r,17s)-3-{[(2e)-4-(acetyloxy)-3,4-dimethylpent-2-enoyl]oxy}-15,16-dihydroxy-9,13-dimethyl-4,11-dioxo-10-{[(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-9-ene-17-carboxylate
4,5-bis(acetyloxy)-6-{[2-(hydroxymethyl)-10-{[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 3-(3-hydroxy-4-methoxyphenyl)prop-2-enoate
6-[(4,5-dihydroxy-2-{[5-hydroxy-2-(4-methoxyphenyl)-4-oxochromen-7-yl]oxy}-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxan-3-yl)oxy]-3,4,5-trihydroxyoxane-2-carboxylic acid
5-[(6-{[5,7-dihydroxy-2-(4-hydroxy-3-methoxyphenyl)-4-oxochromen-3-yl]oxy}-3,4-dihydroxy-5-[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]oxan-2-yl)methoxy]-3-hydroxy-3-methyl-5-oxopentanoic acid
(2s,3s,4r,5r,6s)-4,5-bis(acetyloxy)-6-{[(1s,2s,4s,5s,6s,10s)-2-(hydroxymethyl)-10-{[(2s,3r,4s,5r,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-(3-hydroxy-4-methoxyphenyl)prop-2-enoate
methyl (1r,2s,3r,6r,8s,9s,13s,14s,15r,16s,17r)-3-{[(2e)-4-(acetyloxy)-3,4-dimethylpent-2-enoyl]oxy}-15,16-dihydroxy-9,13-dimethyl-4,12-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-10-ene-17-carboxylate
(2r,3r,4r,5r,6r)-5-hydroxy-6-[2-(3-hydroxy-4-methoxyphenyl)ethoxy]-4-{[(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl]oxy}-2-{[(2r,3r,4s,5s)-3,4,5-trihydroxyoxan-2-yl]methyl}oxan-3-yl (2e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate
(2r,3r,4r,5s,6r)-5-{[(2s,3r,4r,5s,6r)-3,4-dihydroxy-5-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-({[(2r,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-6-({[(2r,3r,4s,5r)-3,4,5-trihydroxyoxan-2-yl]oxy}methyl)oxan-2-yl]oxy}-6-(hydroxymethyl)oxane-2,3,4-triol
methyl (1r,2s,3r,6r,8r,13s,14r,15r,16s,17s)-3-{[(2e)-4-(acetyloxy)-3,4-dimethylpent-2-enoyl]oxy}-15,16-dihydroxy-9,13-dimethyl-4,11-dioxo-10-{[(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-9-ene-17-carboxylate
methyl 3-{[(2e)-4-(acetyloxy)-3,4-dimethylpent-2-enoyl]oxy}-15,16-dihydroxy-9,13-dimethyl-4,12-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-10-ene-17-carboxylate
methyl (1r,2s,3r,6r,8s,9s,13s,14r,15r,16s,17s)-3-{[(2e)-4-(acetyloxy)-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-carboxylate
methyl (1r,2s,3r,6r,8s,13s,14r,15r,16s)-3-{[(2e)-4-(acetyloxy)-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-carboxylate
(3,4,5-trihydroxy-6-{[4-hydroxy-2,5-bis(hydroxymethyl)-3-{[3-(3,4,5-trimethoxyphenyl)prop-2-enoyl]oxy}oxolan-2-yl]oxy}oxan-2-yl)methyl 3-(4-hydroxy-3,5-dimethoxyphenyl)prop-2-enoate
(1s,6s,7r)-4-({[4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2z)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}oxan-2-yl]oxy}methyl)-6,7-bis[(ethoxycarbonyl)oxy]-7-hydroxy-1-methyl-4ah,5h,6h,7ah-cyclopenta[c]pyran-1-yl 3-methylbutanoate
methyl (1r,2s,3r,6r,8r,13s,14r,15r,16s)-3-{[(2e)-4-(acetyloxy)-3,4-dimethylpent-2-enoyl]oxy}-15,16-dihydroxy-9,13-dimethyl-4,11-dioxo-10-{[(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-9-ene-17-carboxylate
(2e)-3-{4-[(1s)-2-(acetyloxy)-1-[(1r,3r,4s,6s,7s)-7-(acetyloxy)-3-[(3r,4r)-4-(acetyloxy)-3-methoxycyclohexa-1,5-dien-1-yl]-4-[(acetyloxy)methyl]-6-methoxy-3,4,6,7-tetrahydro-1h-2-benzopyran-1-yl]ethoxy]-3-methoxyphenyl}prop-2-en-1-yl acetate
(7r,9z,11s,12r,13r,14s,15r,16r,17r,18r,19e,21e)-2,15,17,23,32-pentahydroxy-28-(hydroxymethyl)-11-methoxy-3,7,12,14,16,18,22-heptamethyl-6-oxo-8,33-dioxa-27-thia-24,29-diazapentacyclo[23.6.1.1⁴,⁷.0⁵,³¹.0²⁶,³⁰]tritriaconta-1(31),2,4,9,19,21,23,25(32),26(30),28-decaen-13-yl acetate
C39H48N2O12S (768.2927808000001)
(1s,6s,7r)-4-({[4,5-dihydroxy-6-(hydroxymethyl)-3-{[(2e)-3-(4-hydroxyphenyl)prop-2-enoyl]oxy}oxan-2-yl]oxy}methyl)-6,7-bis[(ethoxycarbonyl)oxy]-7-hydroxy-1-methyl-4ah,5h,6h,7ah-cyclopenta[c]pyran-1-yl 3-methylbutanoate
(9z,19e,21e)-2,15,17,23,32-pentahydroxy-28-(hydroxymethyl)-11-methoxy-3,7,12,14,16,18,22-heptamethyl-6-oxo-8,33-dioxa-27-thia-24,29-diazapentacyclo[23.6.1.1⁴,⁷.0⁵,³¹.0²⁶,³⁰]tritriaconta-1(31),2,4,9,19,21,23,25(32),26(30),28-decaen-13-yl acetate
C39H48N2O12S (768.2927808000001)