Exact Mass: 722.3795

Leupyrrin D

C40H54N2O10 (722.3778)

Suavissimoside F1

C38H58O13 (722.3877)

12-O-Acetylfusicoccin

C38H58O13 (722.3877)

12-O-Acetylisofusicoccin

C38H58O13 (722.3877)

beta-D-oleandropyranosyl-(1->4)-O-beta-D-cymaropyranosyl-(1->4)-O-beta-D-canaropyranosyl-(1->4)-O-beta-D-cymaropyranosyl-(1->4)-O-oleandro-1,5-lactone|perifosaccharide C

C34H58O16 (722.3725)

(2R,3R,4R,5R,7S,8S,9S,11E,13S,15R)-2,3,5,7,8,9,15-heptahydroxyjatropha-6(17),11-diene-14-one-8,9-diacetate-7-isobutyrate-2,5-bis(2-methylbutyrate)|2,3,5,7,8,9,15-heptahydroxyjatropha-6(17),11-diene-14-one 8,9-diacetate 7-isobutyrate 2,5-bis(2-methylbutyrate)

C38H58O13 (722.3877)

Arvenin II

C38H58O13 (722.3877)

Arvenin II is a natural product found in Picrorhiza kurrooa, Citrullus colocynthis, and Cucumis melo with data available.

(2R,3R,4R,5R,7S,8S,9S,11E,13S,15R)-2,3,5,7,8,9,15-heptahydroxyjatropha-6(17),11-diene-14-one-8,9-diacetate-7-isobutyrate-2,3-bis(2-methylbutyrate)|2,3,5,7,8,9,15-heptahydroxyjatropha-6(17),11-diene-14-one 8,9-diacetate 7-isobutyrate 2,3-bis(2-methylbutyrate)

C38H58O13 (722.3877)

(23S)-spirosta-5,25(27)-diene-1beta,3beta,23-triol 1-O-2)-alpha-L-arabinopyranoside>

C38H58O13 (722.3877)

[(6R)-6-hydroxy-6-[(2S,8S,9R,10R,13R,14S,16R)-16-hydroxy-4,4,9,13,14-pentamethyl-3,11-dioxo-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,7,8,10,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methyl-5-oxoheptan-2-yl] acetate

C38H58O13 (722.3877)

C38H58O13

C38H58O13 (722.3877)

[(6R)-6-hydroxy-6-[(2S,8S,9R,10R,13R,14S,16R)-16-hydroxy-4,4,9,13,14-pentamethyl-3,11-dioxo-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,7,8,10,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methyl-5-oxoheptan-2-yl] acetate [IIN-based: Match]

C38H58O13 (722.3877)

2-O-Glucopyranosylcucurbitacin F-25-Acetate

C38H58O13 (722.3877)

2-[2,4-bis(2-methylbutan-2-yl)phenoxy]-N-[4-[5-oxo-4-(1-phenyltetrazol-5-yl)sulfanyl-3-pyrrolidin-1-yl-4H-pyrazol-1-yl]phenyl]butanamide

C40H50N8O3S (722.3726)

[(6R)-6-hydroxy-6-[(2S,8S,9R,10R,13R,14S,16R)-16-hydroxy-4,4,9,13,14-pentamethyl-3,11-dioxo-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-2,7,8,10,12,15,16,17-octahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-methyl-5-oxoheptan-2-yl] acetate

C38H58O13 (722.3877)

HBMP 32:7

C38H59O11P (722.3795)

PG 20:5/12:3;O

C38H59O11P (722.3795)

PG 32:8;O

C38H59O11P (722.3795)

LPIP O-22:0

C31H64O14P2 (722.3771)

2-(acetyloxy)-3,12-dihydroxy-4,6a,6b,11,12,14b-hexamethyl-8a-({[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}carbonyl)-1,2,3,4a,5,6,7,8,9,10,11,12a,14,14a-tetradecahydropicene-4-carboxylic acid

C38H58O13 (722.3877)

2-[(4,5-dihydroxy-2-{7',9',13'-trimethyl-5-methylidene-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-18'-ene-3,16'-dioloxy}oxan-3-yl)oxy]-6-methyloxane-3,4,5-triol

C38H58O13 (722.3877)

2-o-acetylsuavissimoside f1

C38H58O13 (722.3877)

{"Ingredient_id": "HBIN006184","Ingredient_name": "2-o-acetylsuavissimoside f1","Alias": "NA","Ingredient_formula": "C38H58O13","Ingredient_Smile": "CC1CCC2(CCC3(C(=CCC4C3(CCC5C4(CC(C(C5(C)C(=O)O)O)OC(=O)C)C)C)C2C1(C)O)C)C(=O)OC6C(C(C(C(O6)CO)O)O)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "516","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

(2r,3r,4r,5r,7s,8s,9s,11e,13s,15r)-2,3,5,7,8,9,15-heptahydroxyjatropha-6(17),11-diene-14-one-8,9-diacetate-7-isobutyrate-2,3-bis(2-methylbutyrate)

C38H58O13 (722.3877)

{"Ingredient_id": "HBIN006421","Ingredient_name": "(2r,3r,4r,5r,7s,8s,9s,11e,13s,15r)-2,3,5,7,8,9,15-heptahydroxyjatropha-6(17),11-diene-14-one-8,9-diacetate-7-isobutyrate-2,3-bis(2-methylbutyrate)","Alias": "NA","Ingredient_formula": "C38H58O13","Ingredient_Smile": "CCC(C)C(=O)OC1C2C(C(=C)C(C(C(C(C=CC(C(=O)C2(CC1(C)OC(=O)C(C)CC)O)C)(C)C)OC(=O)C)OC(=O)C)OC(=O)C(C)C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "9396","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

(2r,3r,4r,5r,7s,8s,9s,11e,13s,15r)-2,3,5,7,8,9,15-heptahydroxyjatropha-6(17),11-diene-14-one-8,9-diacetate-7-isobutyrate-2,5-bis(2-methylbutyrate)

C38H58O13 (722.3877)

{"Ingredient_id": "HBIN006422","Ingredient_name": "(2r,3r,4r,5r,7s,8s,9s,11e,13s,15r)-2,3,5,7,8,9,15-heptahydroxyjatropha-6(17),11-diene-14-one-8,9-diacetate-7-isobutyrate-2,5-bis(2-methylbutyrate)","Alias": "NA","Ingredient_formula": "C38H58O13","Ingredient_Smile": "CCC(C)C(=O)OC1C2C(C(CC2(C(=O)C(C=CC(C(C(C(C1=C)OC(=O)C(C)C)OC(=O)C)OC(=O)C)(C)C)C)O)(C)OC(=O)C(C)CC)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "9395","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

α-l-rhamnopyranosyl-(1→4)-β-d-glucopyra-nosyl-(1→6)-β-d-glucopyranosyl-(1→6)-β-d-glucopyranosyloleanate-3-α-l-arabinofuranosyl(1→4)-methyl-(β-d-glucuronopyranoside)uronate

C45H54O8 (722.3818)

{"Ingredient_id": "HBIN015594","Ingredient_name": "\u03b1-l-rhamnopyranosyl-(1\u21924)-\u03b2-d-glucopyra-nosyl-(1\u21926)-\u03b2-d-glucopyranosyl-(1\u21926)-\u03b2-d-glucopyranosyloleanate-3-\u03b1-l-arabinofuranosyl(1\u21924)-methyl-(\u03b2-d-glucuronopyranoside)uronate","Alias": "NA","Ingredient_formula": "C45H54O8","Ingredient_Smile": "CC1=CC(=C2C(=C1)C(=O)C3=C(C2=O)C=CC(=C3)OC(=O)C45CCC(C4C6CCC7C(C6(CC5)C)(CCC8C7(C(C(C8(C)C)O)C(=O)O)C)C)C(=C)C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "18697","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

(1r,2r,3ar,5s,9s,10s,11s,13r,13ar)-9,10-bis(acetyloxy)-1,3a-dihydroxy-2,5,8,8-tetramethyl-13-{[(2r)-2-methylbutanoyl]oxy}-12-methylidene-11-[(2-methylpropanoyl)oxy]-4-oxo-1h,3h,5h,9h,10h,11h,13h,13ah-cyclopenta[12]annulen-2-yl (2r)-2-methylbutanoate

C38H58O13 (722.3877)

(7e,9s,12r,13s,16e,21r,22r)-12-(hydroxymethyl)-22-{[(2s,3z,4z)-4-(5-hydroxypentan-2-ylidene)-2-(2-methylpropyl)oxolan-3-ylidene]methyl}-8,12-dimethyl-17-(2-methylpropyl)-10,14,19,24-tetraoxa-23,25-diazatetracyclo[19.2.1.1²,⁵.0⁹,¹³]pentacosa-1(23),2,4,7,16-pentaene-11,15,18-trione

C40H54N2O10 (722.3778)

(2s)-2-[(3r,4s,8r,9r,10r,11s,14s)-4-(acetyloxy)-8-{[(2s,3s,4r,5s,6r)-5-(acetyloxy)-3,4-dihydroxy-6-{[(2-methylbut-3-en-2-yl)oxy]methyl}oxan-2-yl]oxy}-9-hydroxy-14-(methoxymethyl)-3,10-dimethyltricyclo[9.3.0.0³,⁷]tetradeca-1,6-dien-6-yl]propyl acetate

C38H58O13 (722.3877)

(1r,2r,3ar,5s,9s,10s,11s,13r,13as)-9,10-bis(acetyloxy)-3a,13-dihydroxy-2,5,8,8-tetramethyl-1-{[(2r)-2-methylbutanoyl]oxy}-12-methylidene-11-[(2-methylpropanoyl)oxy]-4-oxo-1h,3h,5h,9h,10h,11h,13h,13ah-cyclopenta[12]annulen-2-yl (2r)-2-methylbutanoate

C38H58O13 (722.3877)

(3r,10s,13r,20s,27s,30s,32r,40s)-29,32-dihydroxy-27-isopropyl-10,11-dimethyl-1,7,8,11,17,18,24,25,28,39-decaazaheptacyclo[28.10.0.0³,⁸.0¹³,¹⁸.0²⁰,²⁵.0³²,⁴⁰.0³³,³⁸]tetraconta-28,33,35,37-tetraene-2,9,12,19,26-pentone

C35H50N10O7 (722.3864)

(7e,16e)-12-(hydroxymethyl)-22-{[(3z,4z)-4-(5-hydroxypentan-2-ylidene)-2-(2-methylpropyl)oxolan-3-ylidene]methyl}-8,12-dimethyl-17-(2-methylpropyl)-10,14,19,24-tetraoxa-23,25-diazatetracyclo[19.2.1.1²,⁵.0⁹,¹³]pentacosa-1(23),2,4,7,16-pentaene-11,15,18-trione

C40H54N2O10 (722.3778)

(2s,3r,4r,5r,6s)-2-{[(2s,3r,4s,5s)-4,5-dihydroxy-2-[(1's,2s,2's,3s,4's,7's,8'r,9's,12's,13'r,14'r,16'r)-7',9',13'-trimethyl-5-methylidene-5'-oxaspiro[oxane-2,6'-pentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icosan]-18'-ene-3,16'-dioloxy]oxan-3-yl]oxy}-6-methyloxane-3,4,5-triol

C38H58O13 (722.3877)

(2s)-2-[(3r,4s,8r,9r,10r,11s,14s)-4-(acetyloxy)-8-{[(2s,3r,4s,5r,6r)-4-(acetyloxy)-3,5-dihydroxy-6-{[(2-methylbut-3-en-2-yl)oxy]methyl}oxan-2-yl]oxy}-9-hydroxy-14-(methoxymethyl)-3,10-dimethyltricyclo[9.3.0.0³,⁷]tetradeca-1,6-dien-6-yl]propyl acetate

C38H58O13 (722.3877)

(6r)-6-[(1r,2r,3as,3bs,8s,9ar,9br,11ar)-2-hydroxy-3a,6,6,9b,11a-pentamethyl-7,10-dioxo-8-{[(2r,3r,4r,5r,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,2h,3h,3bh,4h,8h,9h,9ah,11h-cyclopenta[a]phenanthren-1-yl]-6-hydroxy-2-methyl-5-oxoheptan-2-yl acetate

C38H58O13 (722.3877)

(2r,3r,4s,4ar,6ar,6bs,8as,11r,12r,12as,14ar,14br)-2-(acetyloxy)-3,12-dihydroxy-4,6a,6b,11,12,14b-hexamethyl-8a-({[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}carbonyl)-1,2,3,4a,5,6,7,8,9,10,11,12a,14,14a-tetradecahydropicene-4-carboxylic acid

C38H58O13 (722.3877)

9,10-bis(acetyloxy)-3a,13-dihydroxy-2,5,8,8-tetramethyl-2-[(2-methylbutanoyl)oxy]-12-methylidene-11-[(2-methylpropanoyl)oxy]-4-oxo-1h,3h,5h,9h,10h,11h,13h,13ah-cyclopenta[12]annulen-1-yl 2-methylbutanoate

C38H58O13 (722.3877)

(2s)-2-[(1e,3r,4s,8r,9r,10r,11s,14s)-4-(acetyloxy)-8-{[(2s,3s,4r,5s,6r)-5-(acetyloxy)-3,4-dihydroxy-6-{[(2-methylbut-3-en-2-yl)oxy]methyl}oxan-2-yl]oxy}-9-hydroxy-14-(methoxymethyl)-3,10-dimethyltricyclo[9.3.0.0³,⁷]tetradeca-1,6-dien-6-yl]propyl acetate

C38H58O13 (722.3877)

29,32-dihydroxy-27-isopropyl-10,11-dimethyl-1,7,8,11,17,18,24,25,28,39-decaazaheptacyclo[28.10.0.0³,⁸.0¹³,¹⁸.0²⁰,²⁵.0³²,⁴⁰.0³³,³⁸]tetraconta-28,33,35,37-tetraene-2,9,12,19,26-pentone

C35H50N10O7 (722.3864)

(7e,9r,12r,13r,16e,21r,22s)-12-(hydroxymethyl)-22-{[(2s,3z,4z)-4-(5-hydroxypentan-2-ylidene)-2-(2-methylpropyl)oxolan-3-ylidene]methyl}-8,12-dimethyl-17-(2-methylpropyl)-10,14,19,24-tetraoxa-23,25-diazatetracyclo[19.2.1.1²,⁵.0⁹,¹³]pentacosa-1(23),2,4,7,16-pentaene-11,15,18-trione

C40H54N2O10 (722.3778)

(2r,3r,4s,4ar,6ar,6bs,8as,11r,12r,12as,14ar,14bs)-2-(acetyloxy)-3,12-dihydroxy-4,6a,6b,11,12,14b-hexamethyl-8a-({[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}carbonyl)-1,2,3,4a,5,6,7,8,9,10,11,12a,14,14a-tetradecahydropicene-4-carboxylic acid

C38H58O13 (722.3877)

6-hydroxy-6-(2-hydroxy-3a,6,6,9b,11a-pentamethyl-7,10-dioxo-8-{[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,2h,3h,3bh,4h,8h,9h,9ah,11h-cyclopenta[a]phenanthren-1-yl)-2-methyl-5-oxoheptan-2-yl acetate

C38H58O13 (722.3877)

9,10-bis(acetyloxy)-1,3a-dihydroxy-2,5,8,8-tetramethyl-13-[(2-methylbutanoyl)oxy]-12-methylidene-11-[(2-methylpropanoyl)oxy]-4-oxo-1h,3h,5h,9h,10h,11h,13h,13ah-cyclopenta[12]annulen-2-yl 2-methylbutanoate

C38H58O13 (722.3877)

12-(hydroxymethyl)-22-{[4-(5-hydroxypentan-2-ylidene)-2-(2-methylpropyl)oxolan-3-ylidene]methyl}-8,12-dimethyl-17-(2-methylpropyl)-10,14,19,24-tetraoxa-23,25-diazatetracyclo[19.2.1.1²,⁵.0⁹,¹³]pentacosa-1(23),2,4,7,16-pentaene-11,15,18-trione

C40H54N2O10 (722.3778)

(6r)-6-[(1r,2r,3as,3bs,8s,9ar,9br,11ar)-2-hydroxy-3a,6,6,9b,11a-pentamethyl-7,10-dioxo-8-{[(2s,3r,4s,5s,6r)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy}-1h,2h,3h,3bh,4h,8h,9h,9ah,11h-cyclopenta[a]phenanthren-1-yl]-6-hydroxy-2-methyl-5-oxoheptan-2-yl acetate

C38H58O13 (722.3877)

(4r,5r,6r)-5-{[(2s,4s,5r,6r)-5-{[(2s,4r,5s,6r)-4-hydroxy-5-{[(2s,4s,5r,6r)-5-{[(2s,4r,5r,6r)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy}-4-methoxy-6-methyloxan-2-yl]oxy}-6-methyloxan-2-yl]oxy}-4-methoxy-6-methyloxan-2-yl]oxy}-4-methoxy-6-methyloxan-2-one

C34H58O16 (722.3725)

5-[(5-{[4-hydroxy-5-({5-[(5-hydroxy-4-methoxy-6-methyloxan-2-yl)oxy]-4-methoxy-6-methyloxan-2-yl}oxy)-6-methyloxan-2-yl]oxy}-4-methoxy-6-methyloxan-2-yl)oxy]-4-methoxy-6-methyloxan-2-one

C34H58O16 (722.3725)

(2s)-2-[(1e,3r,4s,8r,9r,10r,11s,14s)-4-(acetyloxy)-8-{[(2s,3r,4s,5r,6r)-4-(acetyloxy)-3,5-dihydroxy-6-{[(2-methylbut-3-en-2-yl)oxy]methyl}oxan-2-yl]oxy}-9-hydroxy-14-(methoxymethyl)-3,10-dimethyltricyclo[9.3.0.0³,⁷]tetradeca-1,6-dien-6-yl]propyl acetate

C38H58O13 (722.3877)