Exact Mass: 692.3111

Delta5-calotropin 3-O-beta-D-glucopyranoside

C42H40N6O4

nomilin 17-O-beta-D-glucopyranoside

(2R,3R,4S,5R,7S,8R,13R,15R)-2,3,5,7,15-pentaacetoxy-8-iso-butyroyloxy-9,14-dioxojatropha-6(17),11E-diene

3alpha-O-[beta-apiosyl-(1->6)-beta-glucopyranosyl]-(5beta,9alpha,10alpha)-8(12)-drimen-11-yl-umbelliferone|persicaoside B

C35H48O14

brevianamide S

gumoside A

A natural product found in Ferula gumosa.

3,5,10,14,15-O-pentaacetyl-8-O-2-(methylbutanoyl)-cyclomyrsinol

javanicinoside G

C35H48O14_Butanoic acid, 2-methyl-, (2R,3R,3aS,4R,6S,7R,10E,12R,13aR)-2,3,4,6,13a-pentakis(acetyloxy)-2,3,3a,4,5,6,7,8,9,12,13,13a-dodecahydro-2,9,9,12-tetramethyl-5-methylene-8,13-dioxo-1H-cyclopentacyclododecen-7-yl ester

NCGC00380509-01_C35H48O14_Butanoic acid, 2-methyl-, (2R,3R,3aS,4R,6S,7R,10E,12R,13aR)-2,3,4,6,13a-pentakis(acetyloxy)-2,3,3a,4,5,6,7,8,9,12,13,13a-dodecahydro-2,9,9,12-tetramethyl-5-methylene-8,13-dioxo-1H-cyclopentacyclododecen-7-yl ester

[(1R,2R,3aR,5R,6E,10R,11S,13R,13aS)-1,2,3a,11,13-pentaacetyloxy-2,5,8,8-tetramethyl-12-methylidene-4,9-dioxo-3,5,10,11,13,13a-hexahydro-1H-cyclopenta[12]annulen-10-yl] 2-methylbutanoate_major

[(1R,2R,3aR,5R,6E,10R,11S,13R,13aS)-1,2,3a,11,13-pentaacetyloxy-2,5,8,8-tetramethyl-12-methylidene-4,9-dioxo-3,5,10,11,13,13a-hexahydro-1H-cyclopenta[12]annulen-10-yl] 2-methylbutanoate_0.3\\%

benzene-1,3-dicarboxylic acid,4-[3-(9-carboxynonanoyloxy)-2,2-dimethylpropoxy]carbonyl-2,3-dimethylbenzoic acid,ethane-1,2-diol

spermidine phosphate hexahydrate

C14H59N6O18P3 (692.3099)

(1R,6E)-1beta,2alpha,3abeta,11beta,13alpha-Pentaacetoxy-2,5alpha,8,8-tetramethyl-10alpha-(2-methylbutyryloxy)-12-methylene-2,3,3a,4,5,8,9,10,11,12,13,13aalpha-dodecahydro-1H-cyclopentacyclododecene-4,9-dione

(1R,6E)-1beta,2alpha,3abeta,11beta,13alpha-Pentaacetoxy-2,5alpha,8,8-tetramethyl-10alpha-(2-methylbutyryloxy)-12-methylene-2,3,3a,4,5,8,9,10,11,12,13,13aalpha-dodecahydro-1H-cyclopentacyclododecene-4,9-dione

PI O-23:5;O2

PI P-16:1/7:3;O2

PI 16:1/7:3;O

PI 18:3/5:1;O

PI 23:4;O

ST 29:6;O8;GlcA

(2r,3r,3as,4r,6s,7r,12r,13ar)-2,3,4,6,13a-pentakis(acetyloxy)-2,9,9,12-tetramethyl-5-methylidene-8,13-dioxo-1h,3h,3ah,4h,6h,7h,12h-cyclopenta[12]annulen-7-yl 2-methylbutanoate

4-benzyl-9-{4-benzyl-5-methyl-3,6-dioxo-2,5,16-triazatetracyclo[7.7.0.0²,⁷.0¹⁰,¹⁵]hexadeca-10,12,14-trien-9-yl}-5-methyl-2,5,16-triazatetracyclo[7.7.0.0²,⁷.0¹⁰,¹⁵]hexadeca-10,12,14-triene-3,6-dione

4-benzyl-9-{4-benzyl-5-methyl-3,6-dioxo-2,5,16-triazatetracyclo[7.7.0.0²,⁷.0¹⁰,¹⁵]hexadeca-10,12,14-trien-9-yl}-5-methyl-2,5,16-triazatetracyclo[7.7.0.0²,⁷.0¹⁰,¹⁵]hexadeca-10,12,14-triene-3,6-dione

15-o-deacetyl-15-o-methylnimbolidin a

C39H48O11 (692.3196)

{"Ingredient_id": "HBIN001707","Ingredient_name": "15-o-deacetyl-15-o-methylnimbolidin a","Alias": "NA","Ingredient_formula": "C39H48O11","Ingredient_Smile": "CC1=C(C(CC1C2=COC=C2)OC)C3(C(C4(C(CC(C5(C4C(C3OC(=O)C6=CC=CC=C6)OC5)C)OC(=O)C)OC(=O)C)C)CC(=O)OC)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "4751","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

3-o- beta-D- glucopyranoside

{"Ingredient_id": "HBIN009158","Ingredient_name": "3-o- beta-D- glucopyranoside","Alias": "NA","Ingredient_formula": "C35H48O14","Ingredient_Smile": "CC1CC(C2(C(O1)OC3CC4(C5CCC6(C(CCC6(C5CC=C4CC3O2)O)C7=CC(=O)OC7)C)C=O)OC8C(C(C(C(O8)CO)O)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "36147","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

7-[(6-{[6-({[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-4-hydroxy-5,5,8a-trimethyl-2-methylidene-hexahydro-1h-naphthalen-1-yl)methoxy]chromen-2-one

4,15-dimethoxy-2,14,17-trimethyl-3-oxo-11-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-10-oxatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadecan-16-yl 2h-1,3-benzodioxole-5-carboxylate

5,7-bis(acetyloxy)-10-[3-(furan-3-yl)-5-methoxy-2-methylcyclopent-1-en-1-yl]-9-(2-methoxy-2-oxoethyl)-4,8,10-trimethyl-2-oxatricyclo[6.3.1.0⁴,¹²]dodecan-11-yl benzoate

C39H48O11 (692.3196)

(3r,5s,7r,9s,10s,12r,14s,15s,18r,19r,22s,23r)-10,22-dihydroxy-7,18-dimethyl-19-(5-oxo-2h-furan-3-yl)-9-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4,6,11-trioxahexacyclo[12.11.0.0³,¹².0⁵,¹⁰.0¹⁵,²³.0¹⁸,²²]pentacos-1(25)-ene-14-carbaldehyde

(3r,5s,7r,9s,10s,12r,14s,15s,18r,19r,22s,23r)-10,22-dihydroxy-7,18-dimethyl-19-(5-oxo-2h-furan-3-yl)-9-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4,6,11-trioxahexacyclo[12.11.0.0³,¹².0⁵,¹⁰.0¹⁵,²³.0¹⁸,²²]pentacos-1(25)-ene-14-carbaldehyde

(1s,4s,7s,9s)-4-benzyl-9-[(1s,4s,7s,9s)-4-benzyl-5-methyl-3,6-dioxo-2,5,16-triazatetracyclo[7.7.0.0²,⁷.0¹⁰,¹⁵]hexadeca-10,12,14-trien-9-yl]-5-methyl-2,5,16-triazatetracyclo[7.7.0.0²,⁷.0¹⁰,¹⁵]hexadeca-10,12,14-triene-3,6-dione

(1s,4s,7s,9s)-4-benzyl-9-[(1s,4s,7s,9s)-4-benzyl-5-methyl-3,6-dioxo-2,5,16-triazatetracyclo[7.7.0.0²,⁷.0¹⁰,¹⁵]hexadeca-10,12,14-trien-9-yl]-5-methyl-2,5,16-triazatetracyclo[7.7.0.0²,⁷.0¹⁰,¹⁵]hexadeca-10,12,14-triene-3,6-dione

1-{[(3as,5ar,6r,9as,9bs)-5a-methyl-3-methylidene-2-oxo-9-({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-octahydro-3ah-naphtho[1,2-b]furan-6-yl]oxy}-3-(4-hydroxyphenyl)-1-oxopropan-2-yl 2-hydroxy-3-methylbutanoate

1-{[(3as,5ar,6r,9as,9bs)-5a-methyl-3-methylidene-2-oxo-9-({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-octahydro-3ah-naphtho[1,2-b]furan-6-yl]oxy}-3-(4-hydroxyphenyl)-1-oxopropan-2-yl 2-hydroxy-3-methylbutanoate

2,3,4,6-tetrakis(acetyloxy)-13a-[(acetyloxy)methyl]-2,9,9,12-tetramethyl-5-methylidene-8,13-dioxo-1h,3h,3ah,4h,6h,7h,12h-cyclopenta[12]annulen-7-yl 2-methylpropanoate

(2s)-1-{[(3as,5ar,6r,9r,9as,9bs)-5a-methyl-3-methylidene-2-oxo-9-({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-octahydro-3ah-naphtho[1,2-b]furan-6-yl]oxy}-3-(4-hydroxyphenyl)-1-oxopropan-2-yl (2r)-2-hydroxy-3-methylbutanoate

(2s)-1-{[(3as,5ar,6r,9r,9as,9bs)-5a-methyl-3-methylidene-2-oxo-9-({[(2r,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-octahydro-3ah-naphtho[1,2-b]furan-6-yl]oxy}-3-(4-hydroxyphenyl)-1-oxopropan-2-yl (2r)-2-hydroxy-3-methylbutanoate

(2r,3r,3as,4r,6s,7r,12r,13as)-2,3,4,6-tetrakis(acetyloxy)-13a-[(acetyloxy)methyl]-2,9,9,12-tetramethyl-5-methylidene-8,13-dioxo-1h,3h,3ah,4h,6h,7h,12h-cyclopenta[12]annulen-7-yl 2-methylpropanoate

1-{[5a-methyl-3-methylidene-2-oxo-9-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-octahydro-3ah-naphtho[1,2-b]furan-6-yl]oxy}-3-(4-hydroxyphenyl)-1-oxopropan-2-yl 2-hydroxy-3-methylbutanoate

1-{[5a-methyl-3-methylidene-2-oxo-9-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}methyl)-octahydro-3ah-naphtho[1,2-b]furan-6-yl]oxy}-3-(4-hydroxyphenyl)-1-oxopropan-2-yl 2-hydroxy-3-methylbutanoate

(1s,2s,4s,7r,9r,11s,13s,14r,15s,16s,17s)-4,15-dimethoxy-2,14,17-trimethyl-3-oxo-11-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-10-oxatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadecan-16-yl 2h-1,3-benzodioxole-5-carboxylate

(1s,2s,4s,7r,9r,11s,13s,14r,15s,16s,17s)-4,15-dimethoxy-2,14,17-trimethyl-3-oxo-11-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-10-oxatetracyclo[7.7.1.0²,⁷.0¹³,¹⁷]heptadecan-16-yl 2h-1,3-benzodioxole-5-carboxylate

10,22-dihydroxy-7,18-dimethyl-19-(5-oxo-2h-furan-3-yl)-9-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4,6,11-trioxahexacyclo[12.11.0.0³,¹².0⁵,¹⁰.0¹⁵,²³.0¹⁸,²²]pentacos-1(25)-ene-14-carbaldehyde

10,22-dihydroxy-7,18-dimethyl-19-(5-oxo-2h-furan-3-yl)-9-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-4,6,11-trioxahexacyclo[12.11.0.0³,¹².0⁵,¹⁰.0¹⁵,²³.0¹⁸,²²]pentacos-1(25)-ene-14-carbaldehyde

(1s,2r,3r,4s,5s,7r,8s,9r,10r,11s,12s,14r,15r)-2,4,7,8,12-pentakis(acetyloxy)-5,9,12-trimethyl-16-oxo-18-oxapentacyclo[7.7.2.0¹,¹⁰.0³,⁷.0¹¹,¹⁴]octadecan-15-yl (2r)-2-methylbutanoate

(2r,3r,3as,4r,6s,7s,12s,13ar)-2,3,4,6,13a-pentakis(acetyloxy)-2,9,9,12-tetramethyl-5-methylidene-8,13-dioxo-1h,3h,3ah,4h,6h,7h,12h-cyclopenta[12]annulen-7-yl (2r)-2-methylbutanoate

(3z)-3-{[2-(2-methylbut-3-en-2-yl)-1h-indol-3-yl]methylidene}-8-[(3z)-3-{[2-(2-methylbut-3-en-2-yl)-1h-indol-3-yl]methylidene}-1,4-dioxo-2h,6h,7h-pyrrolo[1,2-a]pyrazin-8-yl]-2h,6h,7h-pyrrolo[1,2-a]pyrazine-1,4-dione

(3z)-3-{[2-(2-methylbut-3-en-2-yl)-1h-indol-3-yl]methylidene}-8-[(3z)-3-{[2-(2-methylbut-3-en-2-yl)-1h-indol-3-yl]methylidene}-1,4-dioxo-2h,6h,7h-pyrrolo[1,2-a]pyrazin-8-yl]-2h,6h,7h-pyrrolo[1,2-a]pyrazine-1,4-dione

2,3,4,6,13a-pentakis(acetyloxy)-2,9,9,12-tetramethyl-5-methylidene-8,13-dioxo-1h,3h,3ah,4h,6h,7h,12h-cyclopenta[12]annulen-7-yl 2-methylbutanoate

(1r,4r,5r,7s,8r,9r,10r,11s,12r)-5,7-bis(acetyloxy)-10-[(3r,5s)-3-(furan-3-yl)-5-methoxy-2-methylcyclopent-1-en-1-yl]-9-(2-methoxy-2-oxoethyl)-4,8,10-trimethyl-2-oxatricyclo[6.3.1.0⁴,¹²]dodecan-11-yl benzoate

(1r,4r,5r,7s,8r,9r,10r,11s,12r)-5,7-bis(acetyloxy)-10-[(3r,5s)-3-(furan-3-yl)-5-methoxy-2-methylcyclopent-1-en-1-yl]-9-(2-methoxy-2-oxoethyl)-4,8,10-trimethyl-2-oxatricyclo[6.3.1.0⁴,¹²]dodecan-11-yl benzoate

C39H48O11 (692.3196)

(1s,4s,7s,9s)-4-benzyl-9-[(1r,4r,7r,9s)-4-benzyl-5-methyl-3,6-dioxo-2,5,16-triazatetracyclo[7.7.0.0²,⁷.0¹⁰,¹⁵]hexadeca-10,12,14-trien-9-yl]-5-methyl-2,5,16-triazatetracyclo[7.7.0.0²,⁷.0¹⁰,¹⁵]hexadeca-10,12,14-triene-3,6-dione

(1s,4s,7s,9s)-4-benzyl-9-[(1r,4r,7r,9s)-4-benzyl-5-methyl-3,6-dioxo-2,5,16-triazatetracyclo[7.7.0.0²,⁷.0¹⁰,¹⁵]hexadeca-10,12,14-trien-9-yl]-5-methyl-2,5,16-triazatetracyclo[7.7.0.0²,⁷.0¹⁰,¹⁵]hexadeca-10,12,14-triene-3,6-dione

1-[4-(acetyloxy)-5-methyl-3-methylidene-6-phenylhexyl]-6-[(4,6-dimethyloctanoyl)oxy]-4,7-dihydroxy-2,8-dioxabicyclo[3.2.1]octane-3,4,5-tricarboxylic acid

7-{[(1r,4s,4as,6r,8as)-6-{[(2r,3r,4s,5s,6r)-6-({[(2r,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-4-hydroxy-5,5,8a-trimethyl-2-methylidene-hexahydro-1h-naphthalen-1-yl]methoxy}chromen-2-one

7-{[(1r,4s,4as,6r,8as)-6-{[(2r,3r,4s,5s,6r)-6-({[(2r,3r,4r)-3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-4-hydroxy-5,5,8a-trimethyl-2-methylidene-hexahydro-1h-naphthalen-1-yl]methoxy}chromen-2-one

3-{[2-(2-methylbut-3-en-2-yl)-1h-indol-3-yl]methylidene}-8-(3-{[2-(2-methylbut-3-en-2-yl)-1h-indol-3-yl]methylidene}-1,4-dioxo-2h,6h,7h-pyrrolo[1,2-a]pyrazin-8-yl)-2h,6h,7h-pyrrolo[1,2-a]pyrazine-1,4-dione

3-{[2-(2-methylbut-3-en-2-yl)-1h-indol-3-yl]methylidene}-8-(3-{[2-(2-methylbut-3-en-2-yl)-1h-indol-3-yl]methylidene}-1,4-dioxo-2h,6h,7h-pyrrolo[1,2-a]pyrazin-8-yl)-2h,6h,7h-pyrrolo[1,2-a]pyrazine-1,4-dione

(1s,3s,4s,5r,6r,7r)-1-[(4s,5r)-4-(acetyloxy)-5-methyl-3-methylidene-6-phenylhexyl]-6-[(4,6-dimethyloctanoyl)oxy]-4,7-dihydroxy-2,8-dioxabicyclo[3.2.1]octane-3,4,5-tricarboxylic acid

2,4,7,8,12-pentakis(acetyloxy)-5,9,12-trimethyl-16-oxo-18-oxapentacyclo[7.7.2.0¹,¹⁰.0³,⁷.0¹¹,¹⁴]octadecan-15-yl 2-methylbutanoate