Exact Mass: 584.1947

Exact Mass Matches: 584.1947

Found 82 metabolites which its exact mass value is equals to given mass value 584.1947, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Benzoylpaeoniflorin

[3-({6-[(benzoyloxy)methyl]-3,4,5-trihydroxyoxan-2-yl}oxy)-6-hydroxy-8-methyl-9,10-dioxatetracyclo[4.3.1.0²,⁵.0³,⁸]decan-2-yl]methyl benzoate

C30H32O12 (584.1894)


Benzoylpaeoniflorin, a natural product from Chinese paeony root, has the potential for coronary heart disease by decreasing apoptosis. Benzoylpaeoniflorin, a natural product from Chinese paeony root, has the potential for coronary heart disease by decreasing apoptosis.

   

Benzoylpaeoniflorin

4-O-benzoylpaeoniflorin

C30H32O12 (584.1894)


Benzoylpaeoniflorin is a terpene glycoside. It has a role as a metabolite. Benzoylpaeoniflorin is a natural product found in Paeonia suffruticosa and Paeonia rockii with data available. A natural product found in Paeonia rockii subspeciesrockii. Benzoylpaeoniflorin, a natural product from Chinese paeony root, has the potential for coronary heart disease by decreasing apoptosis. Benzoylpaeoniflorin, a natural product from Chinese paeony root, has the potential for coronary heart disease by decreasing apoptosis.

   

Sachaliside 2

(2R,3S) -2- (3,4-Dihydroxyphenyl) -3,4-dihydro-3,5-dihydroxy-6- [ (2E) -3- (4-hydroxyphenyl) -2-propenyl ] -2H-1-benzopyran-7-yl beta-D-glucopyranoside

C30H32O12 (584.1894)


   
   

6-Demethoxyneocalycopterone

6-Demethoxyneocalycopterone

C34H32O9 (584.2046)


   
   

6-O-trans-Feruloylnodakenin

6-O-trans-Feruloylnodakenin

C30H32O12 (584.1894)


   
   

Paeonidaninol B

Paeonidaninol B

C30H32O12 (584.1894)


   

11-hydroxybrianthein U

11-hydroxybrianthein U

C28H37ClO11 (584.2024)


   

2-O-feruloyl-7-O-methylaloesin

2-O-feruloyl-7-O-methylaloesin

C30H32O12 (584.1894)


   

nui-inoalide C|Nuiinoalide C

nui-inoalide C|Nuiinoalide C

C28H37ClO11 (584.2024)


   

2-O-benzoylpaeoniflorin

2-O-benzoylpaeoniflorin

C30H32O12 (584.1894)


   

albiflorin R3

albiflorin R3

C30H32O12 (584.1894)


   
   

gnemonoside D

gnemonoside D

C34H32O9 (584.2046)


   

11-hydroxybrianthein Y

11-hydroxybrianthein Y

C28H37ClO11 (584.2024)


   

BIDEBILINE C

BIDEBILINE C

C36H28N2O6 (584.1947)


An isoquinoline alkaloid that is a dimer of 8-methoxydehydroanonaine. Isolated from the roots of Polyalthia debilis, it exhibits moderate antimalarial activity by inhibiting the growth of the malarial parasite Plasmodium falciparum.

   

BIDEBILINE D

BIDEBILINE D

C36H28N2O6 (584.1947)


An isoquinoline alkaloid that is a dimer of 10-methoxydehydroanonaine. Isolated from the roots of Polyalthia debilis, it exhibits moderate antimalarial activity by inhibiting the growth of the malarial parasite Plasmodium falciparum.

   

FORBESOSIDE

[(2R,3S,4S,5R,6S)-3,4,5-trihydroxy-6-[2-[(2R)-7-oxo-2,3-dihydrofuro[3,2-g]chromen-2-yl]propan-2-yloxy]oxan-2-yl]methyl (E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

C30H32O12 (584.1894)


6-Feruloylnodakenin is a natural product found in Hansenia forbesii with data available.

   

Benzoylalbiflorin

[6-[[9-(Benzoyloxymethyl)-4-hydroxy-6-methyl-8-oxo-7-oxatricyclo[4.3.0.03,9]nonan-1-yl]oxy]-3,4,5-trihydroxyoxan-2-yl]methyl benzoate

C30H32O12 (584.1894)


   

C30H32O12_{(1R,2S,3R,5R,6R,8S)-3-[(6-O-Benzoyl-beta-D-glucopyranosyl)oxy]-6-hydroxy-8-methyl-9,10-dioxatetracyclo[4.3.1.0~2,5~.0~3,8~]dec-2-yl}methyl benzoate

NCGC00380749-01_C30H32O12_{(1R,2S,3R,5R,6R,8S)-3-[(6-O-Benzoyl-beta-D-glucopyranosyl)oxy]-6-hydroxy-8-methyl-9,10-dioxatetracyclo[4.3.1.0~2,5~.0~3,8~]dec-2-yl}methyl benzoate

C30H32O12 (584.1894)


   

[(1S,3R,5R,6S,8S)-3-{[(2S,3R,4S,5S,6R)-6-[(benzoyloxy)methyl]-3,4,5-trihydroxyoxan-2-yl]oxy}-6-hydroxy-8-methyl-9,10-dioxatetracyclo[4.3.1.0²,⁵.0³,⁸]decan-2-yl]methyl benzoate

[(1S,3R,5R,6S,8S)-3-{[(2S,3R,4S,5S,6R)-6-[(benzoyloxy)methyl]-3,4,5-trihydroxyoxan-2-yl]oxy}-6-hydroxy-8-methyl-9,10-dioxatetracyclo[4.3.1.0²,⁵.0³,⁸]decan-2-yl]methyl benzoate

C30H32O12 (584.1894)


   

[(1S,3R,5R,6S,8S)-3-{[(2S,3R,4S,5S,6R)-6-[(benzoyloxy)methyl]-3,4,5-trihydroxyoxan-2-yl]oxy}-6-hydroxy-8-methyl-9,10-dioxatetracyclo[4.3.1.0²,?.0³,?]decan-2-yl]methyl benzoate

[(1S,3R,5R,6S,8S)-3-{[(2S,3R,4S,5S,6R)-6-[(benzoyloxy)methyl]-3,4,5-trihydroxyoxan-2-yl]oxy}-6-hydroxy-8-methyl-9,10-dioxatetracyclo[4.3.1.0²,?.0³,?]decan-2-yl]methyl benzoate

C30H32O12 (584.1894)


   
   
   

1-[[(4R,5R)-8-(3-cyanophenyl)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-3-(2,5-difluorophenyl)-1-methylurea

1-[[(4R,5R)-8-(3-cyanophenyl)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-3-(2,5-difluorophenyl)-1-methylurea

C29H30F2N4O5S (584.1905)


   

[(2R,3R,4S,5R,6S)-6-[[(1S,2S,3R,5R,6R,8S)-2-(benzoyloxymethyl)-6-hydroxy-8-methyl-9,10-dioxatetracyclo[4.3.1.02,5.03,8]decan-3-yl]oxy]-3,4,5-trihydroxyoxan-2-yl]methyl benzoate

[(2R,3R,4S,5R,6S)-6-[[(1S,2S,3R,5R,6R,8S)-2-(benzoyloxymethyl)-6-hydroxy-8-methyl-9,10-dioxatetracyclo[4.3.1.02,5.03,8]decan-3-yl]oxy]-3,4,5-trihydroxyoxan-2-yl]methyl benzoate

C30H32O12 (584.1894)


   

1-[(2S,3S)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-phenylurea

1-[(2S,3S)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-phenylurea

C30H34Cl2N4O4 (584.1957)


   

N-[(2R,3R)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-pyridinecarboxamide

N-[(2R,3R)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-pyridinecarboxamide

C30H34Cl2N4O4 (584.1957)


   

1-[[(4R,5S)-8-(3-cyanophenyl)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-3-(2,5-difluorophenyl)-1-methylurea

1-[[(4R,5S)-8-(3-cyanophenyl)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-3-(2,5-difluorophenyl)-1-methylurea

C29H30F2N4O5S (584.1905)


   

1-[(2S,3S)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-phenylurea

1-[(2S,3S)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-phenylurea

C30H34Cl2N4O4 (584.1957)


   

1-[[(4S,5R)-8-(3-cyanophenyl)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-3-(2,5-difluorophenyl)-1-methylurea

1-[[(4S,5R)-8-(3-cyanophenyl)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-3-(2,5-difluorophenyl)-1-methylurea

C29H30F2N4O5S (584.1905)


   

1-[[(4R,5R)-8-(3-cyanophenyl)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-3-(2,5-difluorophenyl)-1-methylurea

1-[[(4R,5R)-8-(3-cyanophenyl)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-3-(2,5-difluorophenyl)-1-methylurea

C29H30F2N4O5S (584.1905)


   

1-[[(4R,5S)-8-(3-cyanophenyl)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-3-(2,5-difluorophenyl)-1-methylurea

1-[[(4R,5S)-8-(3-cyanophenyl)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-3-(2,5-difluorophenyl)-1-methylurea

C29H30F2N4O5S (584.1905)


   

1-[[(4S,5S)-8-(3-cyanophenyl)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-3-(2,5-difluorophenyl)-1-methylurea

1-[[(4S,5S)-8-(3-cyanophenyl)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-3-(2,5-difluorophenyl)-1-methylurea

C29H30F2N4O5S (584.1905)


   

1-[[(4S,5R)-8-(3-cyanophenyl)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-3-(2,5-difluorophenyl)-1-methylurea

1-[[(4S,5R)-8-(3-cyanophenyl)-2-[(2S)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-3-(2,5-difluorophenyl)-1-methylurea

C29H30F2N4O5S (584.1905)


   

1-[(2R,3S)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-phenylurea

1-[(2R,3S)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-phenylurea

C30H34Cl2N4O4 (584.1957)


   

N-[(2R,3S)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-pyridinecarboxamide

N-[(2R,3S)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-pyridinecarboxamide

C30H34Cl2N4O4 (584.1957)


   

N-[(2S,3R)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-pyridinecarboxamide

N-[(2S,3R)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-pyridinecarboxamide

C30H34Cl2N4O4 (584.1957)


   

N-[(2R,3R)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-pyridinecarboxamide

N-[(2R,3R)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-pyridinecarboxamide

C30H34Cl2N4O4 (584.1957)


   

N-[(2R,3S)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-pyridinecarboxamide

N-[(2R,3S)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-pyridinecarboxamide

C30H34Cl2N4O4 (584.1957)


   

N-[(2S,3S)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-pyridinecarboxamide

N-[(2S,3S)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-pyridinecarboxamide

C30H34Cl2N4O4 (584.1957)


   

N-[(2S,3R)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-pyridinecarboxamide

N-[(2S,3R)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-pyridinecarboxamide

C30H34Cl2N4O4 (584.1957)


   

N-[(2S,3S)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-pyridinecarboxamide

N-[(2S,3S)-2-[[(3,4-dichlorophenyl)methyl-methylamino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-2,3,4,7-tetrahydro-1,5-benzoxazonin-9-yl]-4-pyridinecarboxamide

C30H34Cl2N4O4 (584.1957)


   

1-[[(4S,5S)-8-(3-cyanophenyl)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-3-(2,5-difluorophenyl)-1-methylurea

1-[[(4S,5S)-8-(3-cyanophenyl)-2-[(2R)-1-hydroxypropan-2-yl]-4-methyl-1,1-dioxo-4,5-dihydro-3H-6,1$l^{6},2-benzoxathiazocin-5-yl]methyl]-3-(2,5-difluorophenyl)-1-methylurea

C29H30F2N4O5S (584.1905)


   

[(2R,3S,4S,5R,6S)-6-[[(1S,3R,5R,6S,8S)-2-(benzoyloxymethyl)-6-hydroxy-8-methyl-9,10-dioxatetracyclo[4.3.1.02,5.03,8]decan-3-yl]oxy]-3,4,5-trihydroxyoxan-2-yl]methyl benzoate

[(2R,3S,4S,5R,6S)-6-[[(1S,3R,5R,6S,8S)-2-(benzoyloxymethyl)-6-hydroxy-8-methyl-9,10-dioxatetracyclo[4.3.1.02,5.03,8]decan-3-yl]oxy]-3,4,5-trihydroxyoxan-2-yl]methyl benzoate

C30H32O12 (584.1894)


   

paeonin A

paeonin A

C30H32O12 (584.1894)


A natural product found in Paeonia emodi.

   

[(1s,2s,3r,5r,6r,8s)-3-({6-[(benzoyloxy)methyl]-3,4,5-trihydroxyoxan-2-yl}oxy)-6-hydroxy-8-methyl-9,10-dioxatetracyclo[4.3.1.0²,⁵.0³,⁸]decan-2-yl]methyl benzoate

[(1s,2s,3r,5r,6r,8s)-3-({6-[(benzoyloxy)methyl]-3,4,5-trihydroxyoxan-2-yl}oxy)-6-hydroxy-8-methyl-9,10-dioxatetracyclo[4.3.1.0²,⁵.0³,⁸]decan-2-yl]methyl benzoate

C30H32O12 (584.1894)


   

(1r,2r,3r,5r,7s,8r,11r,12r,13r,14s,15r,16r,17s,19r)-2,13-bis(acetyloxy)-7-chloro-12-hydroxy-1,11,15-trimethyl-6-methylidene-10-oxo-4,9,18-trioxapentacyclo[12.5.0.0³,⁵.0⁸,¹².0¹⁷,¹⁹]nonadecan-16-yl butanoate

(1r,2r,3r,5r,7s,8r,11r,12r,13r,14s,15r,16r,17s,19r)-2,13-bis(acetyloxy)-7-chloro-12-hydroxy-1,11,15-trimethyl-6-methylidene-10-oxo-4,9,18-trioxapentacyclo[12.5.0.0³,⁵.0⁸,¹².0¹⁷,¹⁹]nonadecan-16-yl butanoate

C28H37ClO11 (584.2024)


   

[(2r,3s,4s,5r,6s)-6-{[(1s,6s,8s,9r)-9-[(benzoyloxy)methyl]-8-hydroxy-6-methyl-4-oxo-7-oxatricyclo[4.3.0.0³,⁹]nonan-1-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl benzoate

[(2r,3s,4s,5r,6s)-6-{[(1s,6s,8s,9r)-9-[(benzoyloxy)methyl]-8-hydroxy-6-methyl-4-oxo-7-oxatricyclo[4.3.0.0³,⁹]nonan-1-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl benzoate

C30H32O12 (584.1894)


   

[(2r,3s,4s,5r,6s)-6-({9-[(benzoyloxy)methyl]-4-hydroxy-6-methyl-8-oxo-7-oxatricyclo[4.3.0.0³,⁹]nonan-1-yl}oxy)-3,4,5-trihydroxyoxan-2-yl]methyl benzoate

[(2r,3s,4s,5r,6s)-6-({9-[(benzoyloxy)methyl]-4-hydroxy-6-methyl-8-oxo-7-oxatricyclo[4.3.0.0³,⁹]nonan-1-yl}oxy)-3,4,5-trihydroxyoxan-2-yl]methyl benzoate

C30H32O12 (584.1894)


   

[(2r,3s,4s,5r,6s)-6-{[(1r,4r)-9-[(benzoyloxy)methyl]-4-hydroxy-6-methyl-8-oxo-7-oxatricyclo[4.3.0.0³,⁹]nonan-1-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl benzoate

[(2r,3s,4s,5r,6s)-6-{[(1r,4r)-9-[(benzoyloxy)methyl]-4-hydroxy-6-methyl-8-oxo-7-oxatricyclo[4.3.0.0³,⁹]nonan-1-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl benzoate

C30H32O12 (584.1894)


   

6''-demethoxyneocalycopterone

NA

C34H32O9 (584.2046)


{"Ingredient_id": "HBIN012307","Ingredient_name": "6''-demethoxyneocalycopterone","Alias": "NA","Ingredient_formula": "C34H32O9","Ingredient_Smile": "COC1=CC(=O)C2C=CC(OC23C1(C4=C(C(=C5C(=C4O3)C(CC(O5)C6=CC=CC=C6)O)OC)OC)OC)C7=CC=CC=C7","Ingredient_weight": "584.6 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5050","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "101727393","DrugBank_id": "NA"}

   

6'-O-trans-feruloylnodakenin

6'-o-trans-feruloylnodakenin

C30H32O12 (584.1894)


{"Ingredient_id": "HBIN012719","Ingredient_name": "6'-O-trans-feruloylnodakenin","Alias": "6'-o-trans-feruloylnodakenin","Ingredient_formula": "C30H32O12","Ingredient_Smile": "CC(C)(C1CC2=C(O1)C=C3C(=C2)C=CC(=O)O3)OC4C(C(C(C(O4)COC(=O)C=CC5=CC(=C(C=C5)O)OC)O)O)O","Ingredient_weight": "584.6 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "38137","TCMSP_id": "NA","TCM_ID_id": "21432","PubChem_id": "102060651","DrugBank_id": "NA"}

   

[(2r,3s,4s,5r,6s)-6-{[(1s,3s,4r,6s,9s)-9-[(benzoyloxy)methyl]-4-hydroxy-6-methyl-8-oxo-7-oxatricyclo[4.3.0.0³,⁹]nonan-1-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl benzoate

[(2r,3s,4s,5r,6s)-6-{[(1s,3s,4r,6s,9s)-9-[(benzoyloxy)methyl]-4-hydroxy-6-methyl-8-oxo-7-oxatricyclo[4.3.0.0³,⁹]nonan-1-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl benzoate

C30H32O12 (584.1894)


   

(1s,2s,3r,4r,7r,8s,10r,12s,13r,14s)-2,10,14-tris(acetyloxy)-8-chloro-3-hydroxy-4,13-dimethyl-9,17-dimethylidene-5-oxo-6-oxatricyclo[11.4.0.0³,⁷]heptadecan-12-yl acetate

(1s,2s,3r,4r,7r,8s,10r,12s,13r,14s)-2,10,14-tris(acetyloxy)-8-chloro-3-hydroxy-4,13-dimethyl-9,17-dimethylidene-5-oxo-6-oxatricyclo[11.4.0.0³,⁷]heptadecan-12-yl acetate

C28H37ClO11 (584.2024)


   

{3,4,5-trihydroxy-6-[(2-{7-oxo-2h,3h-furo[3,2-g]chromen-2-yl}propan-2-yl)oxy]oxan-2-yl}methyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

{3,4,5-trihydroxy-6-[(2-{7-oxo-2h,3h-furo[3,2-g]chromen-2-yl}propan-2-yl)oxy]oxan-2-yl}methyl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

C30H32O12 (584.1894)


   

[(2s,3r,5r,6r,8s)-3-{[(2s,3r,4s,5r,6r)-6-[(benzoyloxy)methyl]-3,4,5-trihydroxyoxan-2-yl]oxy}-6-hydroxy-8-methyl-9,10-dioxatetracyclo[4.3.1.0²,⁵.0³,⁸]decan-2-yl]methyl benzoate

[(2s,3r,5r,6r,8s)-3-{[(2s,3r,4s,5r,6r)-6-[(benzoyloxy)methyl]-3,4,5-trihydroxyoxan-2-yl]oxy}-6-hydroxy-8-methyl-9,10-dioxatetracyclo[4.3.1.0²,⁵.0³,⁸]decan-2-yl]methyl benzoate

C30H32O12 (584.1894)


   

{1-[(4,5-dihydroxycyclohex-2-ene-1-carbonyloxy)methyl]-3-{5,7-dioxatricyclo[4.2.1.0³,⁹]nona-3,6(9)-dien-1-yloxy}-5,6-dihydroxy-4-methyl-2-oxabicyclo[2.2.1]heptan-3-yl}methyl benzoate

{1-[(4,5-dihydroxycyclohex-2-ene-1-carbonyloxy)methyl]-3-{5,7-dioxatricyclo[4.2.1.0³,⁹]nona-3,6(9)-dien-1-yloxy}-5,6-dihydroxy-4-methyl-2-oxabicyclo[2.2.1]heptan-3-yl}methyl benzoate

C30H32O12 (584.1894)


   

(1s,5r,7s,13s,20s)-5-hydroxy-10,11,13,14-tetramethoxy-7,20-diphenyl-2,8,21-trioxapentacyclo[11.8.0.0¹,¹⁷.0³,¹².0⁴,⁹]henicosa-3,9,11,14,17-pentaen-16-one

(1s,5r,7s,13s,20s)-5-hydroxy-10,11,13,14-tetramethoxy-7,20-diphenyl-2,8,21-trioxapentacyclo[11.8.0.0¹,¹⁷.0³,¹².0⁴,⁹]henicosa-3,9,11,14,17-pentaen-16-one

C34H32O9 (584.2046)


   

2-[(1s)-1-(2,4-dihydroxy-6-methylphenyl)hexyl]-1,3,8-trihydroxy-6-(3-hydroxy-5-methylphenoxy)anthracene-9,10-dione

2-[(1s)-1-(2,4-dihydroxy-6-methylphenyl)hexyl]-1,3,8-trihydroxy-6-(3-hydroxy-5-methylphenoxy)anthracene-9,10-dione

C34H32O9 (584.2046)


   

[(1s,3s,5s,6r,8s)-3-{[(2s,3r,5s,6r)-6-[(benzoyloxy)methyl]-3,4,5-trihydroxyoxan-2-yl]oxy}-6-hydroxy-8-methyl-9,10-dioxatetracyclo[4.3.1.0²,⁵.0³,⁸]decan-2-yl]methyl benzoate

[(1s,3s,5s,6r,8s)-3-{[(2s,3r,5s,6r)-6-[(benzoyloxy)methyl]-3,4,5-trihydroxyoxan-2-yl]oxy}-6-hydroxy-8-methyl-9,10-dioxatetracyclo[4.3.1.0²,⁵.0³,⁸]decan-2-yl]methyl benzoate

C30H32O12 (584.1894)


   

[(2r,3s,4s,5r,6s)-6-{[(1s,3s,6r,8r,9r)-9-[(benzoyloxy)methyl]-8-hydroxy-6-methyl-4-oxo-7-oxatricyclo[4.3.0.0³,⁹]nonan-1-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl benzoate

[(2r,3s,4s,5r,6s)-6-{[(1s,3s,6r,8r,9r)-9-[(benzoyloxy)methyl]-8-hydroxy-6-methyl-4-oxo-7-oxatricyclo[4.3.0.0³,⁹]nonan-1-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl benzoate

C30H32O12 (584.1894)


   

7-methoxy-13-{7-methoxy-3,5-dioxa-11-azapentacyclo[10.7.1.0²,⁶.0⁸,²⁰.0¹⁴,¹⁹]icosa-1(20),2(6),7,12,14(19),15,17-heptaen-13-yl}-3,5-dioxa-11-azapentacyclo[10.7.1.0²,⁶.0⁸,²⁰.0¹⁴,¹⁹]icosa-1(20),2(6),7,12,14(19),15,17-heptaene

7-methoxy-13-{7-methoxy-3,5-dioxa-11-azapentacyclo[10.7.1.0²,⁶.0⁸,²⁰.0¹⁴,¹⁹]icosa-1(20),2(6),7,12,14(19),15,17-heptaen-13-yl}-3,5-dioxa-11-azapentacyclo[10.7.1.0²,⁶.0⁸,²⁰.0¹⁴,¹⁹]icosa-1(20),2(6),7,12,14(19),15,17-heptaene

C36H28N2O6 (584.1947)


   

[(2r,3s,4s,5r,6s)-6-{[(1r,3r,6s,8s,9s)-9-[(benzoyloxy)methyl]-8-hydroxy-6-methyl-4-oxo-7-oxatricyclo[4.3.0.0³,⁹]nonan-1-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl benzoate

[(2r,3s,4s,5r,6s)-6-{[(1r,3r,6s,8s,9s)-9-[(benzoyloxy)methyl]-8-hydroxy-6-methyl-4-oxo-7-oxatricyclo[4.3.0.0³,⁹]nonan-1-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl benzoate

C30H32O12 (584.1894)


   

[(1s,2r,3s,5s,6s,8r)-3-{[(2s,3r,4s,5r,6r)-6-[(benzoyloxy)methyl]-3,4,5-trihydroxyoxan-2-yl]oxy}-6-hydroxy-8-methyl-9,10-dioxatetracyclo[4.3.1.0²,⁵.0³,⁸]decan-2-yl]methyl benzoate

[(1s,2r,3s,5s,6s,8r)-3-{[(2s,3r,4s,5r,6r)-6-[(benzoyloxy)methyl]-3,4,5-trihydroxyoxan-2-yl]oxy}-6-hydroxy-8-methyl-9,10-dioxatetracyclo[4.3.1.0²,⁵.0³,⁸]decan-2-yl]methyl benzoate

C30H32O12 (584.1894)


   

[(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-[(2-{7-oxo-2h,3h-furo[3,2-g]chromen-2-yl}propan-2-yl)oxy]oxan-2-yl]methyl (2e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

[(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-[(2-{7-oxo-2h,3h-furo[3,2-g]chromen-2-yl}propan-2-yl)oxy]oxan-2-yl]methyl (2e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

C30H32O12 (584.1894)


   

[(2r,3s,4s,5r,6s)-6-{[(1s,3r,6s,8s,9r)-9-[(benzoyloxy)methyl]-8-hydroxy-6-methyl-4-oxo-7-oxatricyclo[4.3.0.0³,⁹]nonan-1-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl benzoate

[(2r,3s,4s,5r,6s)-6-{[(1s,3r,6s,8s,9r)-9-[(benzoyloxy)methyl]-8-hydroxy-6-methyl-4-oxo-7-oxatricyclo[4.3.0.0³,⁹]nonan-1-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl benzoate

C30H32O12 (584.1894)


   

2-{[2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-6-[3-(4-hydroxyphenyl)prop-2-en-1-yl]-3,4-dihydro-2h-1-benzopyran-7-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

2-{[2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-6-[3-(4-hydroxyphenyl)prop-2-en-1-yl]-3,4-dihydro-2h-1-benzopyran-7-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C30H32O12 (584.1894)


   

(2s,3r,4s,5s,6r)-2-{[(2r,3s)-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-6-[(2e)-3-(4-hydroxyphenyl)prop-2-en-1-yl]-3,4-dihydro-2h-1-benzopyran-7-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

(2s,3r,4s,5s,6r)-2-{[(2r,3s)-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-6-[(2e)-3-(4-hydroxyphenyl)prop-2-en-1-yl]-3,4-dihydro-2h-1-benzopyran-7-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C30H32O12 (584.1894)


   

2,12,14-tris(acetyloxy)-8-chloro-3-hydroxy-4,13-dimethyl-9,17-dimethylidene-5-oxo-6-oxatricyclo[11.4.0.0³,⁷]heptadecan-10-yl acetate

2,12,14-tris(acetyloxy)-8-chloro-3-hydroxy-4,13-dimethyl-9,17-dimethylidene-5-oxo-6-oxatricyclo[11.4.0.0³,⁷]heptadecan-10-yl acetate

C28H37ClO11 (584.2024)


   

1,3,6,8-tetrahydroxy-2-{1-[2-hydroxy-4-(3-hydroxy-5-methylphenoxy)-6-methylphenyl]hexyl}anthracene-9,10-dione

1,3,6,8-tetrahydroxy-2-{1-[2-hydroxy-4-(3-hydroxy-5-methylphenoxy)-6-methylphenyl]hexyl}anthracene-9,10-dione

C34H32O9 (584.2046)


   

(2s,3r,4s,5s,6s)-2-{[(2r,3r)-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-6-[(2e)-3-(4-hydroxyphenyl)prop-2-en-1-yl]-3,4-dihydro-2h-1-benzopyran-7-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

(2s,3r,4s,5s,6s)-2-{[(2r,3r)-2-(3,4-dihydroxyphenyl)-3,5-dihydroxy-6-[(2e)-3-(4-hydroxyphenyl)prop-2-en-1-yl]-3,4-dihydro-2h-1-benzopyran-7-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

C30H32O12 (584.1894)


   

(2s,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-2-[7-methoxy-5-methyl-4-oxo-2-(2-oxopropyl)chromen-8-yl]oxan-3-yl (2e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

(2s,3r,4s,5s,6r)-4,5-dihydroxy-6-(hydroxymethyl)-2-[7-methoxy-5-methyl-4-oxo-2-(2-oxopropyl)chromen-8-yl]oxan-3-yl (2e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

C30H32O12 (584.1894)


   

[(2r,3s,4s,5r,6s)-6-{[(1r,3r,6s,8r,9s)-9-[(benzoyloxy)methyl]-8-hydroxy-6-methyl-4-oxo-7-oxatricyclo[4.3.0.0³,⁹]nonan-1-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl benzoate

[(2r,3s,4s,5r,6s)-6-{[(1r,3r,6s,8r,9s)-9-[(benzoyloxy)methyl]-8-hydroxy-6-methyl-4-oxo-7-oxatricyclo[4.3.0.0³,⁹]nonan-1-yl]oxy}-3,4,5-trihydroxyoxan-2-yl]methyl benzoate

C30H32O12 (584.1894)


   

16-methoxy-13-{16-methoxy-3,5-dioxa-11-azapentacyclo[10.7.1.0²,⁶.0⁸,²⁰.0¹⁴,¹⁹]icosa-1(20),2(6),7,12,14(19),15,17-heptaen-13-yl}-3,5-dioxa-11-azapentacyclo[10.7.1.0²,⁶.0⁸,²⁰.0¹⁴,¹⁹]icosa-1(20),2(6),7,12,14(19),15,17-heptaene

16-methoxy-13-{16-methoxy-3,5-dioxa-11-azapentacyclo[10.7.1.0²,⁶.0⁸,²⁰.0¹⁴,¹⁹]icosa-1(20),2(6),7,12,14(19),15,17-heptaen-13-yl}-3,5-dioxa-11-azapentacyclo[10.7.1.0²,⁶.0⁸,²⁰.0¹⁴,¹⁹]icosa-1(20),2(6),7,12,14(19),15,17-heptaene

C36H28N2O6 (584.1947)


   

[(1r,2s,3s,5s,6r,8s)-3-{[(2s,3r,4s,5s,6r)-6-[(benzoyloxy)methyl]-3,4,5-trihydroxyoxan-2-yl]oxy}-6-hydroxy-8-methyl-9,10-dioxatetracyclo[4.3.1.0²,⁵.0³,⁸]decan-2-yl]methyl benzoate

[(1r,2s,3s,5s,6r,8s)-3-{[(2s,3r,4s,5s,6r)-6-[(benzoyloxy)methyl]-3,4,5-trihydroxyoxan-2-yl]oxy}-6-hydroxy-8-methyl-9,10-dioxatetracyclo[4.3.1.0²,⁵.0³,⁸]decan-2-yl]methyl benzoate

C30H32O12 (584.1894)


   

[(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-({2-[(2r)-7-oxo-2h,3h-furo[3,2-g]chromen-2-yl]propan-2-yl}oxy)oxan-2-yl]methyl (2e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

[(2r,3s,4s,5r,6s)-3,4,5-trihydroxy-6-({2-[(2r)-7-oxo-2h,3h-furo[3,2-g]chromen-2-yl]propan-2-yl}oxy)oxan-2-yl]methyl (2e)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

C30H32O12 (584.1894)


   

1,3,6,8-tetrahydroxy-2-[(1s)-1-[2-hydroxy-4-(3-hydroxy-5-methylphenoxy)-6-methylphenyl]hexyl]anthracene-9,10-dione

1,3,6,8-tetrahydroxy-2-[(1s)-1-[2-hydroxy-4-(3-hydroxy-5-methylphenoxy)-6-methylphenyl]hexyl]anthracene-9,10-dione

C34H32O9 (584.2046)


   

2-[1-(2,4-dihydroxy-6-methylphenyl)hexyl]-1,3,8-trihydroxy-6-(3-hydroxy-5-methylphenoxy)anthracene-9,10-dione

2-[1-(2,4-dihydroxy-6-methylphenyl)hexyl]-1,3,8-trihydroxy-6-(3-hydroxy-5-methylphenoxy)anthracene-9,10-dione

C34H32O9 (584.2046)


   

4,5-dihydroxy-6-(hydroxymethyl)-2-[7-methoxy-5-methyl-4-oxo-2-(2-oxopropyl)chromen-8-yl]oxan-3-yl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

4,5-dihydroxy-6-(hydroxymethyl)-2-[7-methoxy-5-methyl-4-oxo-2-(2-oxopropyl)chromen-8-yl]oxan-3-yl 3-(4-hydroxy-3-methoxyphenyl)prop-2-enoate

C30H32O12 (584.1894)