Chemical Formula: C14H18O6
Chemical Formula C14H18O6
Found 83 metabolite its formula value is C14H18O6
Multiplolide B
Multiplolide B
A 10-membered lactone obtained from 10-methyl-9,10-dihydro-2H-oxecin-2-one by the epoxidation of the double bond at position 3-4 and cis-dihydroxylation of the double bond at position 7-8, with further acylation of the hydroxy group at position 8 by a but-2-enoyl group. Multiplolide B was first isolated from the fungus Xylaria multiplex BCC 1111. It shows antifungal activity against Candida albicans. The epoxide group has cis-configuration, but its configuration relative to the other substituents was not established.
2,3-Dihydroxymethyl-4-(3,4-dimethoxyphenyl)-??-butyrolactone
2,3-Dihydroxymethyl-4-(3,4-dimethoxyphenyl)-??-butyrolactone
(6R,12R,14R)-(3E,9E)-12-hydroxy-6,14-dimethyl-1,7-dioxacyclotetradeca-3,9-diene-2,8,11-trione|11-Ketonee-Colletodiol|6R,12R,14R-colletoketol|colletoketol|grahamimycin A|Grahamimycin A1
(6R,12R,14R)-(3E,9E)-12-hydroxy-6,14-dimethyl-1,7-dioxacyclotetradeca-3,9-diene-2,8,11-trione|11-Ketonee-Colletodiol|6R,12R,14R-colletoketol|colletoketol|grahamimycin A|Grahamimycin A1
(Z)-2-(4-hydroxyphenyl)ethenyl-alpha-L-rhamnopyranoside
(Z)-2-(4-hydroxyphenyl)ethenyl-alpha-L-rhamnopyranoside
(3S*,4S*)-3,4-dihydro-3,4,8-trihydroxy-6-methoxy-7-(1-methoxyethyl)naphthalen-1(2H)-one|botryosphaerone C
(3S*,4S*)-3,4-dihydro-3,4,8-trihydroxy-6-methoxy-7-(1-methoxyethyl)naphthalen-1(2H)-one|botryosphaerone C
6-hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-3,7-dioxabicyclo-[3.3.0]-octane
6-hydroxy-2-(4-hydroxy-3,5-dimethoxyphenyl)-3,7-dioxabicyclo-[3.3.0]-octane
(-)-grahamimycin A1|(R,R)-(-)-Grahamimycin A1|grahamimycin|Grahamimycin A1
(-)-grahamimycin A1|(R,R)-(-)-Grahamimycin A1|grahamimycin|Grahamimycin A1
(E)-4,5,6,7-tetrahydroxy-2-benzylhept-2-enoic acid|drypearmoracein A
(E)-4,5,6,7-tetrahydroxy-2-benzylhept-2-enoic acid|drypearmoracein A
1,4-Di Me ether,di-Ac-3,6-Dimethyl-1,2,4,5-benzenetetrol
1,4-Di Me ether,di-Ac-3,6-Dimethyl-1,2,4,5-benzenetetrol
(3R*,4R*)-3,4-dihydro-3,4,8-trihydroxy-3-(2-hydroxypropyl)-6-methoxynaphthalen-1(2H)-one|balticol E
(3R*,4R*)-3,4-dihydro-3,4,8-trihydroxy-3-(2-hydroxypropyl)-6-methoxynaphthalen-1(2H)-one|balticol E
Succinic acid 1-butyl 4-(5-formyl-2-furylmethyl) ester
Succinic acid 1-butyl 4-(5-formyl-2-furylmethyl) ester
Di-Me ether,Me ester-1,3-Dihydro-3,7-dihydroxy-5-methoxy-6-methyl-4-isobenzofurancarboxylic acid
Di-Me ether,Me ester-1,3-Dihydro-3,7-dihydroxy-5-methoxy-6-methyl-4-isobenzofurancarboxylic acid
Methyl 4,6-O-benzylidene-α-D-glucopyranoside
6-Methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxine-7,8-diol
relative retention time with respect to 9-anthracene Carboxylic Acid is 0.717 relative retention time with respect to 9-anthracene Carboxylic Acid is 0.718
C14H18O6_Heptonic acid, 4,7-anhydro-2-deoxy-7-C-phenyl-, methyl ester
NCGC00384932-01_C14H18O6_Heptonic acid, 4,7-anhydro-2-deoxy-7-C-phenyl-, methyl ester
methyl 3-(3,4-dihydroxy-5-phenyloxolan-2-yl)-3-hydroxypropanoate
methyl 3-(3,4-dihydroxy-5-phenyloxolan-2-yl)-3-hydroxypropanoate
Di(2-methoxyethyl) phthalate
BIS(2-METHOXYETHYL) PHTHALATE
CONFIDENCE standard compound; INTERNAL_ID 397; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7846; ORIGINAL_PRECURSOR_SCAN_NO 7843 CONFIDENCE standard compound; INTERNAL_ID 397; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7826; ORIGINAL_PRECURSOR_SCAN_NO 7822 CONFIDENCE standard compound; INTERNAL_ID 397; DATASET 20200303_ENTACT_RP_MIX505; DATA_PROCESSING MERGING RMBmix ver. 0.2.7; DATA_PROCESSING PRESCREENING Shinyscreen ver. 0.8.0; ORIGINAL_ACQUISITION_NO 7851; ORIGINAL_PRECURSOR_SCAN_NO 7849
methyl 3-(3,4-dihydroxy-5-phenyloxolan-2-yl)-3-hydroxypropanoate_0.5\\%
methyl 3-(3,4-dihydroxy-5-phenyloxolan-2-yl)-3-hydroxypropanoate_0.5\\%
methyl 3-(3,4-dihydroxy-5-phenyloxolan-2-yl)-3-hydroxypropanoate_major
methyl 3-(3,4-dihydroxy-5-phenyloxolan-2-yl)-3-hydroxypropanoate_major
bis(2,3-epoxypropyl) cyclohex-4-ene-1,2-dicarboxylate
bis(2,3-epoxypropyl) cyclohex-4-ene-1,2-dicarboxylate
a-D-Mannopyranoside, methyl4,6-O-(phenylmethylene)-
a-D-Mannopyranoside, methyl4,6-O-(phenylmethylene)-
3-oxo-3-(2,3,4-trimethoxyphenyl)propionic acid ethyl ester
3-oxo-3-(2,3,4-trimethoxyphenyl)propionic acid ethyl ester
Methyl alpha-D-ribofuranoside 5-(4-methylbenzoate)
Methyl alpha-D-ribofuranoside 5-(4-methylbenzoate)
Diethyl 2,5-dioxobicyclo[2.2.2]octane-1,4-dicarboxylate
Diethyl 2,5-dioxobicyclo[2.2.2]octane-1,4-dicarboxylate
2-[3-[(3,3-Dimethyloxiran-2-yl)methyl]-4,6-dihydroxy-2-methoxyphenyl]acetic acid
2-[3-[(3,3-Dimethyloxiran-2-yl)methyl]-4,6-dihydroxy-2-methoxyphenyl]acetic acid
3-carboxy-4-methyl-5-(4-oxopentyl)-2-furanpropanoic acid
3-carboxy-4-methyl-5-(4-oxopentyl)-2-furanpropanoic acid
6-(2-hydroxy-3-methoxy-5-oxofuran-2-yl)-1,3,6-trimethyl-7-oxabicyclo[2.2.1]heptan-2-one
6-(2-hydroxy-3-methoxy-5-oxofuran-2-yl)-1,3,6-trimethyl-7-oxabicyclo[2.2.1]heptan-2-one
3-ethoxy-5-hydroxy-7-methoxy-4-(methoxymethyl)-6-methyl-3h-2-benzofuran-1-one
3-ethoxy-5-hydroxy-7-methoxy-4-(methoxymethyl)-6-methyl-3h-2-benzofuran-1-one
(2r,3r,4r,5r,6s)-2-{[(1z)-2-(4-hydroxyphenyl)ethenyl]oxy}-6-methyloxane-3,4,5-triol
(2r,3r,4r,5r,6s)-2-{[(1z)-2-(4-hydroxyphenyl)ethenyl]oxy}-6-methyloxane-3,4,5-triol
(1's,2s,3's,6'r,7'r,9'r)-6'-hydroxy-3-methoxy-3',7',9'-trimethyl-5',8'-dioxaspiro[furan-2,4'-tricyclo[4.2.1.0³,⁷]nonan]-5-one
(1's,2s,3's,6'r,7'r,9'r)-6'-hydroxy-3-methoxy-3',7',9'-trimethyl-5',8'-dioxaspiro[furan-2,4'-tricyclo[4.2.1.0³,⁷]nonan]-5-one
methyl 4-(3-acetyl-2,6-dihydroxyphenyl)-2-methoxybutanoate
methyl 4-(3-acetyl-2,6-dihydroxyphenyl)-2-methoxybutanoate
(1s,4r,6r,7r,8e,10s)-7-hydroxy-4-methyl-2-oxo-3,11-dioxabicyclo[8.1.0]undec-8-en-6-yl (2e)-but-2-enoate
(1s,4r,6r,7r,8e,10s)-7-hydroxy-4-methyl-2-oxo-3,11-dioxabicyclo[8.1.0]undec-8-en-6-yl (2e)-but-2-enoate
2,3-dihydroxymethyl-4-(3',4'-dimethoxyphenyl)-γ-butyrolactone
NA
{"Ingredient_id": "HBIN004053","Ingredient_name": "2,3-dihydroxymethyl-4-(3',4'-dimethoxyphenyl)-\u03b3-butyrolactone","Alias": "NA","Ingredient_formula": "C14H18O6","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT15124","TCMID_id": "6028","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}
7-hydroxy-4-methyl-2-oxo-3,11-dioxabicyclo[8.1.0]undec-8-en-6-yl but-2-enoate
7-hydroxy-4-methyl-2-oxo-3,11-dioxabicyclo[8.1.0]undec-8-en-6-yl but-2-enoate
(2e,4s,5r,6s)-2-benzyl-4,5,6,7-tetrahydroxyhept-2-enoic acid
(2e,4s,5r,6s)-2-benzyl-4,5,6,7-tetrahydroxyhept-2-enoic acid
{5-[(1s)-1-hydroxyethyl]-4-methoxy-2-oxopyran-3-yl}methyl 3-methylbut-2-enoate
{5-[(1s)-1-hydroxyethyl]-4-methoxy-2-oxopyran-3-yl}methyl 3-methylbut-2-enoate
[5-(1-hydroxyethyl)-4-methoxy-2-oxopyran-3-yl]methyl 3-methylbut-2-enoate
[5-(1-hydroxyethyl)-4-methoxy-2-oxopyran-3-yl]methyl 3-methylbut-2-enoate
(2s,3r,4r,5s,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl 2-phenylacetate
(2s,3r,4r,5s,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl 2-phenylacetate
(2r,3s,4e,7s)-7-hydroxy-2-methyl-6,10-dioxo-3,7,8,9-tetrahydro-2h-oxecin-3-yl (2e)-but-2-enoate
(2r,3s,4e,7s)-7-hydroxy-2-methyl-6,10-dioxo-3,7,8,9-tetrahydro-2h-oxecin-3-yl (2e)-but-2-enoate
2-hydroxyethyl (2e)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate
2-hydroxyethyl (2e)-3-(3,4,5-trimethoxyphenyl)prop-2-enoate
(3e,6s,9e,11s,14s)-11-hydroxy-6,14-dimethyl-1,7-dioxacyclotetradeca-3,9-diene-2,5,8-trione
(3e,6s,9e,11s,14s)-11-hydroxy-6,14-dimethyl-1,7-dioxacyclotetradeca-3,9-diene-2,5,8-trione
(1r,3r,4s,6s)-6-[(2s)-2-hydroxy-3-methoxy-5-oxofuran-2-yl]-1,3,6-trimethyl-7-oxabicyclo[2.2.1]heptan-2-one
(1r,3r,4s,6s)-6-[(2s)-2-hydroxy-3-methoxy-5-oxofuran-2-yl]-1,3,6-trimethyl-7-oxabicyclo[2.2.1]heptan-2-one
(3s)-3-ethoxy-5-hydroxy-7-methoxy-4-(methoxymethyl)-6-methyl-3h-2-benzofuran-1-one
(3s)-3-ethoxy-5-hydroxy-7-methoxy-4-(methoxymethyl)-6-methyl-3h-2-benzofuran-1-one
(1s,4r,6r,7s,8e,10s)-7-hydroxy-4-methyl-2-oxo-3,11-dioxabicyclo[8.1.0]undec-8-en-6-yl (2e)-but-2-enoate
(1s,4r,6r,7s,8e,10s)-7-hydroxy-4-methyl-2-oxo-3,11-dioxabicyclo[8.1.0]undec-8-en-6-yl (2e)-but-2-enoate
6-(2-butyl-4-hydroxy-5-oxooxolan-2-yl)-4-methoxypyran-2-one
6-(2-butyl-4-hydroxy-5-oxooxolan-2-yl)-4-methoxypyran-2-one
(2e)-2-benzyl-4,5,6,7-tetrahydroxyhept-2-enoic acid
(2e)-2-benzyl-4,5,6,7-tetrahydroxyhept-2-enoic acid
methyl (3r)-3-[(2s,3s,4s,5r)-3,4-dihydroxy-5-phenyloxolan-2-yl]-3-hydroxypropanoate
methyl (3r)-3-[(2s,3s,4s,5r)-3,4-dihydroxy-5-phenyloxolan-2-yl]-3-hydroxypropanoate
3,4,5-trihydroxy-6-methyloxan-2-yl 2-phenylacetate
3,4,5-trihydroxy-6-methyloxan-2-yl 2-phenylacetate
(2s,3r,4s,5s,6r)-2-(4-ethenylphenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol
(2s,3r,4s,5s,6r)-2-(4-ethenylphenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol
2-(4-ethenylphenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol
2-(4-ethenylphenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol
(2s,3s,4r,5r)-2-(4-ethenylphenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol
(2s,3s,4r,5r)-2-(4-ethenylphenoxy)-6-(hydroxymethyl)oxane-3,4,5-triol
7-hydroxy-2-methyl-6,10-dioxo-3,7,8,9-tetrahydro-2h-oxecin-3-yl but-2-enoate
7-hydroxy-2-methyl-6,10-dioxo-3,7,8,9-tetrahydro-2h-oxecin-3-yl but-2-enoate
6-[(2r,4r)-2-butyl-4-hydroxy-5-oxooxolan-2-yl]-4-methoxypyran-2-one
6-[(2r,4r)-2-butyl-4-hydroxy-5-oxooxolan-2-yl]-4-methoxypyran-2-one
2-hydroxyethyl 3-(3,4,5-trimethoxyphenyl)prop-2-enoate
2-hydroxyethyl 3-(3,4,5-trimethoxyphenyl)prop-2-enoate
(2r,3r,4r,5r,6s)-2-{[(1e)-2-(4-hydroxyphenyl)ethenyl]oxy}-6-methyloxane-3,4,5-triol
(2r,3r,4r,5r,6s)-2-{[(1e)-2-(4-hydroxyphenyl)ethenyl]oxy}-6-methyloxane-3,4,5-triol
(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl 2-phenylacetate
(2s,3r,4r,5r,6s)-3,4,5-trihydroxy-6-methyloxan-2-yl 2-phenylacetate
6'-hydroxy-3-methoxy-3',7',9'-trimethyl-5',8'-dioxaspiro[furan-2,4'-tricyclo[4.2.1.0³,⁷]nonan]-5-one
6'-hydroxy-3-methoxy-3',7',9'-trimethyl-5',8'-dioxaspiro[furan-2,4'-tricyclo[4.2.1.0³,⁷]nonan]-5-one
(3r)-5,6,7,8-tetramethoxy-3-methyl-3,4-dihydro-2-benzopyran-1-one
(3r)-5,6,7,8-tetramethoxy-3-methyl-3,4-dihydro-2-benzopyran-1-one
2-{[2-(4-hydroxyphenyl)ethenyl]oxy}-6-methyloxane-3,4,5-triol
2-{[2-(4-hydroxyphenyl)ethenyl]oxy}-6-methyloxane-3,4,5-triol
(3s,4s)-3,4,8-trihydroxy-6-methoxy-7-[(1r)-1-methoxyethyl]-3,4-dihydro-2h-naphthalen-1-one
(3s,4s)-3,4,8-trihydroxy-6-methoxy-7-[(1r)-1-methoxyethyl]-3,4-dihydro-2h-naphthalen-1-one
(3z,6r,9z,12r,14r)-12-hydroxy-6,14-dimethyl-1,7-dioxacyclotetradeca-3,9-diene-2,8,11-trione
(3z,6r,9z,12r,14r)-12-hydroxy-6,14-dimethyl-1,7-dioxacyclotetradeca-3,9-diene-2,8,11-trione