Exact Mass: 540.310025

Ciclesonide

2-[(1S,2S,4R,8S,9S,11S,12S,13R)-6-cyclohexyl-11-hydroxy-9,13-dimethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.0^{2,9}.0^{4,8}.0^{13,18}]icosa-14,17-dien-8-yl]-2-oxoethyl 2-methylpropanoate

R - Respiratory system > R03 - Drugs for obstructive airway diseases > R03B - Other drugs for obstructive airway diseases, inhalants > R03BA - Glucocorticoids R - Respiratory system > R01 - Nasal preparations > R01A - Decongestants and other nasal preparations for topical use > R01AD - Corticosteroids D006730 - Hormones, Hormone Substitutes, and Hormone Antagonists > D006728 - Hormones > D005938 - Glucocorticoids COVID info from Guide to PHARMACOLOGY, clinicaltrial, clinicaltrials, clinical trial, clinical trials C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone C308 - Immunotherapeutic Agent > C574 - Immunosuppressant > C211 - Therapeutic Corticosteroid D018926 - Anti-Allergic Agents Corona-virus Coronavirus SARS-CoV-2 COVID-19 SARS-CoV COVID19 SARS2 SARS

Ciclesonide

2-[(1S,2S,4R,8S,9S,11S,12S,13R)-6-cyclohexyl-11-hydroxy-9,13-dimethyl-16-oxo-5,7-dioxapentacyclo[10.8.0.0^{2,9}.0^{4,8}.0^{13,18}]icosa-14,17-dien-8-yl]-2-oxoethyl 2-methylpropanoate

Ciclesonide is only found in individuals that have used or taken this drug. It is a glucocorticoid used to treat obstructive airway diseases. It is marketed under the brand name Alvesco.Glucocorticoids such as ciclesonide can inhibit leukocyte infiltration at the site of inflammation, interfere with mediators of inflammatory response, and suppress humoral immune responses. The antiinflammatory actions of glucocorticoids are thought to involve phospholipase A2 inhibitory proteins, lipocortins, which control the biosynthesis of potent mediators of inflammation such as prostaglandins and leukotrienes. Ciclesonide reduces inflammatory reaction by limiting the capillary dilatation and permeability of the vascular structures. These compounds restrict the accumulation of polymorphonuclear leukocytes and macrophages and reduce the release of vasoactive kinins. Recent research suggests that corticosteroids may inhibit the release of arachidonic acid from phospholipids, thereby reducing the formation of prostaglandins. Ciclesonide is a glucocorticoid receptor agonist. On binding, the corticoreceptor-ligand complex translocates itself into the cell nucleus, where it binds to many glucocorticoid response elements (GRE) in the promoter region of the target genes. The DNA bound receptor then interacts with basic transcription factors, causing an increase or decrease in expression of specific target genes, including suppression of IL2 (interleukin 2) expression.

Bisacutifolone A

Globostellatic acid A

A tricyclic triterpenoid of the isomalabaricane group.

5-Ketomilbemycin A4

11-Cinnamoyl,12-Ac- Condurangamine B|condurangogenin C

3-O-(2E ,4E-Decadienoyl)-20-O-acetylingenol

[(4S,5S,6R,10R,12R,14R)-7-(acetyloxymethyl)-5,6-dihydroxy-3,11,11,14-tetramethyl-15-oxo-4-tetracyclo[7.5.1.01,5.010,12]pentadeca-2,7-dienyl] (2E,4E)-deca-2,4-dienoate

20-O-acetyl-[5-O-(2E,4Z)-decadienoyl]-ingenol|5-O-(2E,4Z-decadienoyl)-20-O-acetylingenol

C32H44O7

Tomentidin

3-O-(2E,4Z-decadienoyl)-5-O-acetylingenol

crocacin D

petuniasterone K

16-acetoxy-22alpha-hydroxy-29-nor-24-methyl-6,7-epoxycycloart-1,24(24a)-dien-3,23-dion-3,4-lactone|6,7-epoxyneomacrolactone

ethyl 3,7,11,12,15,23-hexaoxo-5alpha-lanost-8-en-26-oate

Delphicrispuline

Tricholidic acid

1,3,7-tri-O-acetyl-14,15-deoxyhavanensin|14,15-deoxyhavanensin triacetate

bisacutifolone B

heteroclitalactone M

2-acetyl cucurbitacin S

Lys His Ala Val Ser

12b-O-[octa-2Z,4E-dienoyl]-13_-isobutyroyloxy-4b-deoxyphorbol

"12b-O-[octa-2Z,4E-dienoyl]-13_-isobutyroyloxy-4b-deoxyphorbol "

Ingenol O-Decadienoyl, O-Ac or isomer putative

12-O-[octa-2Z,4E-dienoyl]-13-isobutyroyloxy-4-deoxyphorbol

Glu His Lys Lys

(2S)-6-amino-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]-3-(1H-imidazol-4-yl)propanamido]hexanamido]hexanoic acid

Glu Lys His Lys

(2S)-6-amino-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-2-amino-4-carboxybutanamido]hexanamido]-3-(1H-imidazol-4-yl)propanamido]hexanoic acid

Glu Lys Lys His

(4S)-4-amino-4-{[(1S)-5-amino-1-{[(1S)-5-amino-1-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}pentyl]carbamoyl}pentyl]carbamoyl}butanoic acid

His Glu Lys Lys

(2S)-6-amino-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-4-carboxybutanamido]hexanamido]hexanoic acid

His Lys Glu Lys

(2S)-6-amino-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]hexanamido]-4-carboxybutanamido]hexanoic acid

His Lys Lys Glu

(2S)-2-[(2S)-6-amino-2-[(2S)-6-amino-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]hexanamido]hexanamido]pentanedioic acid

His Lys Arg Thr

(2S,3R)-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]hexanamido]-5-carbamimidamidopentanamido]-3-hydroxybutanoic acid

His Lys Thr Arg

(2S)-2-[(2S,3R)-2-[(2S)-6-amino-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]hexanamido]-3-hydroxybutanamido]-5-carbamimidamidopentanoic acid

His Arg Lys Thr

(2S,3R)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-5-carbamimidamidopentanamido]hexanamido]-3-hydroxybutanoic acid

His Arg Thr Lys

(2S)-6-amino-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-5-carbamimidamidopentanamido]-3-hydroxybutanamido]hexanoic acid

His Thr Lys Arg

(2S)-2-[(2S)-6-amino-2-[(2S,3R)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-hydroxybutanamido]hexanamido]-5-carbamimidamidopentanoic acid

His Thr Arg Lys

(2S)-6-amino-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-hydroxybutanamido]-5-carbamimidamidopentanamido]hexanoic acid

Lys Glu His Lys

(2S)-6-amino-2-[(2S)-2-[(2S)-4-carboxy-2-[(2S)-2,6-diaminohexanamido]butanamido]-3-(1H-imidazol-4-yl)propanamido]hexanoic acid

Lys Glu Lys His

(4S)-4-{[(1S)-5-amino-1-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}pentyl]carbamoyl}-4-[(2S)-2,6-diaminohexanamido]butanoic acid

Lys His Glu Lys

(2S)-6-amino-2-[(2S)-4-carboxy-2-[(2S)-2-[(2S)-2,6-diaminohexanamido]-3-(1H-imidazol-4-yl)propanamido]butanamido]hexanoic acid

Lys His Lys Glu

(2S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2,6-diaminohexanamido]-3-(1H-imidazol-4-yl)propanamido]hexanamido]pentanedioic acid

Lys His Arg Thr

(2S,3R)-2-[(2S)-5-carbamimidamido-2-[(2S)-2-[(2S)-2,6-diaminohexanamido]-3-(1H-imidazol-4-yl)propanamido]pentanamido]-3-hydroxybutanoic acid

Lys His Thr Arg

(2S)-5-carbamimidamido-2-[(2S,3R)-2-[(2S)-2-[(2S)-2,6-diaminohexanamido]-3-(1H-imidazol-4-yl)propanamido]-3-hydroxybutanamido]pentanoic acid

Lys Lys Glu His

(4S)-4-[(2S)-6-amino-2-[(2S)-2,6-diaminohexanamido]hexanamido]-4-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}butanoic acid

Lys Lys His Glu

(2S)-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-2,6-diaminohexanamido]hexanamido]-3-(1H-imidazol-4-yl)propanamido]pentanedioic acid

Lys Arg His Thr

(2S,3R)-2-[(2S)-2-[(2S)-5-carbamimidamido-2-[(2S)-2,6-diaminohexanamido]pentanamido]-3-(1H-imidazol-4-yl)propanamido]-3-hydroxybutanoic acid

Lys Arg Thr His

(2S)-2-[(2S,3R)-2-[(2S)-5-carbamimidamido-2-[(2S)-2,6-diaminohexanamido]pentanamido]-3-hydroxybutanamido]-3-(1H-imidazol-4-yl)propanoic acid

Lys Thr His Arg

(2S)-5-carbamimidamido-2-[(2S)-2-[(2S,3R)-2-[(2S)-2,6-diaminohexanamido]-3-hydroxybutanamido]-3-(1H-imidazol-4-yl)propanamido]pentanoic acid

Lys Thr Arg His

(2S)-2-[(2S)-5-carbamimidamido-2-[(2S,3R)-2-[(2S)-2,6-diaminohexanamido]-3-hydroxybutanamido]pentanamido]-3-(1H-imidazol-4-yl)propanoic acid

Arg His Lys Thr

(2S,3R)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-3-(1H-imidazol-4-yl)propanamido]hexanamido]-3-hydroxybutanoic acid

Arg His Thr Lys

(2S)-6-amino-2-[(2S,3R)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-3-(1H-imidazol-4-yl)propanamido]-3-hydroxybutanamido]hexanoic acid

Arg Lys His Thr

(2S,3R)-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-2-amino-5-carbamimidamidopentanamido]hexanamido]-3-(1H-imidazol-4-yl)propanamido]-3-hydroxybutanoic acid

Arg Lys Thr His

(2S)-2-[(2S,3R)-2-[(2S)-6-amino-2-[(2S)-2-amino-5-carbamimidamidopentanamido]hexanamido]-3-hydroxybutanamido]-3-(1H-imidazol-4-yl)propanoic acid

Arg Thr His Lys

(2S)-6-amino-2-[(2S)-2-[(2S,3R)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-3-hydroxybutanamido]-3-(1H-imidazol-4-yl)propanamido]hexanoic acid

Arg Thr Lys His

(2S)-2-[(2S)-6-amino-2-[(2S,3R)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-3-hydroxybutanamido]hexanamido]-3-(1H-imidazol-4-yl)propanoic acid

Thr His Lys Arg

(2S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-(1H-imidazol-4-yl)propanamido]hexanamido]-5-carbamimidamidopentanoic acid

Thr His Arg Lys

(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-3-(1H-imidazol-4-yl)propanamido]-5-carbamimidamidopentanamido]hexanoic acid

Thr Lys His Arg

(2S)-2-[(2S)-2-[(2S)-6-amino-2-[(2S,3R)-2-amino-3-hydroxybutanamido]hexanamido]-3-(1H-imidazol-4-yl)propanamido]-5-carbamimidamidopentanoic acid

Thr Lys Arg His

(2S)-2-[(2S)-2-[(2S)-6-amino-2-[(2S,3R)-2-amino-3-hydroxybutanamido]hexanamido]-5-carbamimidamidopentanamido]-3-(1H-imidazol-4-yl)propanoic acid

Thr Arg His Lys

(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-5-carbamimidamidopentanamido]-3-(1H-imidazol-4-yl)propanamido]hexanoic acid

Thr Arg Lys His

(2S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S,3R)-2-amino-3-hydroxybutanamido]-5-carbamimidamidopentanamido]hexanamido]-3-(1H-imidazol-4-yl)propanoic acid

KHAVS

Lys-His-Ala-Val-Ser

Petromylidene A

2-(E)-(3-methylbutylidene)-7alpha,12alpha,24-trihydroxy-5alpha-cholan-3-one-24-sulfate

C29H48O7S (540.3120577999999)

1-(3-((((2S,3S,4R,5R)-5-(6-aMino-9H-purin-9-yl)-3,4-dihydroxytetrahydrofuran-2-yl)Methyl)(isopropyl)aMino)propyl)-3-(4-(tert-butyl)phenyl)urea

C27H40N8O4 (540.317236)

3-O-(2E ,4Z-decadienoyl)-20-O-acetylingenol

Saridegib hydrochloride

C29H49ClN2O3S (540.3152234)

C274 - Antineoplastic Agent > C163758 - Targeted Therapy Agent > C188731 - Hedgehog Pathway Inhibitor C274 - Antineoplastic Agent > C2189 - Signal Transduction Inhibitor

1-[(2S,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-(4-fluorophenyl)urea

1-[(2R,3S)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-(4-fluorophenyl)urea

1-[(2S,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-(4-fluorophenyl)urea

1-[(2R,3S)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-8-yl]-3-(4-fluorophenyl)urea

1-[(2R,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-(4-fluorophenyl)urea

1-[(2S,3S)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-(4-fluorophenyl)urea

1-[(2S,3R)-2-[[cyclohexylmethyl(methyl)amino]methyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-3,4-dihydro-2H-1,5-benzoxazocin-10-yl]-3-(4-fluorophenyl)urea

(2R,3S)-8-[3-(dimethylamino)prop-1-ynyl]-5-[(2R)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-6-one

C33H40N4O3 (540.310025)

(2R,3S)-8-[3-(dimethylamino)prop-1-ynyl]-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-2-[[methyl-[(4-phenylphenyl)methyl]amino]methyl]-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-6-one

C33H40N4O3 (540.310025)

[1-Hydroxy-3-[hydroxy-(3-hydroxy-2-propanoyloxypropoxy)phosphoryl]oxypropan-2-yl] hexadecanoate

[1-[(2-Acetyloxy-3-hydroxypropoxy)-hydroxyphosphoryl]oxy-3-hydroxypropan-2-yl] heptadecanoate

[1-[(2-Heptanoyloxy-3-hydroxypropoxy)-hydroxyphosphoryl]oxy-3-hydroxypropan-2-yl] dodecanoate

[1-[(2-Butanoyloxy-3-hydroxypropoxy)-hydroxyphosphoryl]oxy-3-hydroxypropan-2-yl] pentadecanoate

[1-Hydroxy-3-[hydroxy-(3-hydroxy-2-pentanoyloxypropoxy)phosphoryl]oxypropan-2-yl] tetradecanoate

[1-Hydroxy-3-[hydroxy-(3-hydroxy-2-octanoyloxypropoxy)phosphoryl]oxypropan-2-yl] undecanoate

[1-[(2-Hexanoyloxy-3-hydroxypropoxy)-hydroxyphosphoryl]oxy-3-hydroxypropan-2-yl] tridecanoate

[1-Hydroxy-3-[hydroxy-(3-hydroxy-2-nonanoyloxypropoxy)phosphoryl]oxypropan-2-yl] decanoate

[1-[2,3-Dihydroxypropoxy(hydroxy)phosphoryl]oxy-3-nonanoyloxypropan-2-yl] decanoate

[1-Acetyloxy-3-[2,3-dihydroxypropoxy(hydroxy)phosphoryl]oxypropan-2-yl] heptadecanoate

[1-[2,3-Dihydroxypropoxy(hydroxy)phosphoryl]oxy-3-pentanoyloxypropan-2-yl] tetradecanoate

[1-Butanoyloxy-3-[2,3-dihydroxypropoxy(hydroxy)phosphoryl]oxypropan-2-yl] pentadecanoate

[1-[2,3-Dihydroxypropoxy(hydroxy)phosphoryl]oxy-3-hexanoyloxypropan-2-yl] tridecanoate

[1-[2,3-Dihydroxypropoxy(hydroxy)phosphoryl]oxy-3-heptanoyloxypropan-2-yl] dodecanoate

[1-[2,3-Dihydroxypropoxy(hydroxy)phosphoryl]oxy-3-octanoyloxypropan-2-yl] undecanoate

[1-[2,3-Dihydroxypropoxy(hydroxy)phosphoryl]oxy-3-propanoyloxypropan-2-yl] hexadecanoate

Ingenol O-Decaenoyl, O-Ac or isomer putative

PG 15:0/4:0

PG 17:0/2:0

PG 19:0

PG 2:0_17:0

ST 26:5;O;GlcA

ST 26:6;O2;Hex

2-{3-[1-(3-hydroxy-5-methyl-6-oxo-2,3-dihydropyran-2-yl)ethyl]-3a,9b-dimethyl-6'-oxo-1,2,3,4,7,8-hexahydrospiro[cyclopenta[a]naphthalene-6,3'-oxan]-7-yl}propan-2-yl acetate

{7,7,12,16-tetramethyl-15-[1-(5-methyl-6-oxo-2,3-dihydropyran-2-yl)ethyl]-5-oxo-6,19-dioxapentacyclo[9.8.0.0¹,¹⁸.0²,⁸.0¹²,¹⁶]nonadec-10-en-2-yl}methyl acetate

7,9-dimethoxy-n-{5-[(2-methoxy-2-oxoethyl)-c-hydroxycarbonimidoyl]pent-1-en-1-yl}-3,6,8-trimethyl-11-phenylundeca-2,4,10-trienimidic acid

{15-[1-(3-hydroxy-5-methyl-6-oxo-2,3-dihydropyran-2-yl)ethyl]-7,7,12,16-tetramethyl-5-oxo-6-oxatetracyclo[9.7.0.0²,⁸.0¹²,¹⁶]octadeca-1(18),10-dien-2-yl}methyl acetate

(2s,4s,7r,8s,9s,12r,13r,16r,17s,18r)-16-(acetyloxy)-2,9,13,17-tetramethyl-7-(4-methyl-2-oxopent-3-en-1-yl)-6-oxo-5-oxapentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icos-1(20)-ene-17-carboxylic acid

(1s,4s,5s,6r,9s,10r,12r,14r)-7-[(acetyloxy)methyl]-5,6-dihydroxy-3,11,11,14-tetramethyl-15-oxotetracyclo[7.5.1.0¹,⁵.0¹⁰,¹²]pentadeca-2,7-dien-4-yl (2z,4e)-deca-2,4-dienoate

(e,2e,4e,6s,7s,8r,9s,10e)-7,9-dimethoxy-n-[(1z)-5-[(2-methoxy-2-oxoethyl)-c-hydroxycarbonimidoyl]pent-1-en-1-yl]-3,6,8-trimethyl-11-phenylundeca-2,4,10-trienimidic acid

(1r,3br,4r,5as,7r,9s,9as,9br,11as)-7,9-bis(acetyloxy)-1-(furan-3-yl)-3b,6,6,9a,11a-pentamethyl-1h,2h,4h,5h,5ah,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-4-yl acetate

2,3-bis(2h-1,3-benzodioxol-5-ylmethyl)-4-hydroxybutyl dodecanoate

3-o-(2' e,4' e-decadienoyl)-20-o-acetylingenol

{"Ingredient_id": "HBIN008996","Ingredient_name": "3-o-(2' e,4' e-decadienoyl)-20-o-acetylingenol","Alias": "NA","Ingredient_formula": "C32H44O7","Ingredient_Smile": "CCCCCC=CC=CC(=O)OC1C(=CC23C1(C(C(=CC(C2=O)C4C(C4(C)C)CC3C)COC(=O)C)O)O)C","Ingredient_weight": "540.7 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT14914","TCMID_id": "4819","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "102004598","DrugBank_id": "NA"}

3-o-(2' e,4'z-decadienoyl)-20-o-acetylingenol

{"Ingredient_id": "HBIN008999","Ingredient_name": "3-o-(2' e,4'z-decadienoyl)-20-o-acetylingenol","Alias": "NA","Ingredient_formula": "C32H44O7","Ingredient_Smile": "CCCCCC=CC=CC(=O)OC1C(=CC23C1(C(C(=CC(C2=O)C4C(C4(C)C)CC3C)COC(=O)C)O)O)C","Ingredient_weight": "540.7 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT14916","TCMID_id": "4821","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "102004599","DrugBank_id": "NA"}

3-o-(2' e,4'z-decadienoyl)-5-o-acetylingenol

{"Ingredient_id": "HBIN009000","Ingredient_name": "3-o-(2' e,4'z-decadienoyl)-5-o-acetylingenol","Alias": "NA","Ingredient_formula": "C32H44O7","Ingredient_Smile": "CCCCCC=CC=CC(=O)OC1C(=CC23C1(C(C(=CC(C2=O)C4C(C4(C)C)CC3C)CO)OC(=O)C)O)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT14915","TCMID_id": "4820","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

bisacutifolone a

{"Ingredient_id": "HBIN018595","Ingredient_name": "bisacutifolone a","Alias": "NA","Ingredient_formula": "C32H44O7","Ingredient_Smile": "CC1CCC2(C1(C(=O)C=C(C2C)C3CCC(C4=C3C(=O)C5(C(CCC5(C4C)C)C)C(=O)OC)O)C(=O)OC)C","Ingredient_weight": "540.7 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "2429","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "10506624","DrugBank_id": "NA"}

bisacutifolone b

{"Ingredient_id": "HBIN018598","Ingredient_name": "bisacutifolone b","Alias": "NA","Ingredient_formula": "C32H44O7","Ingredient_Smile": "CC1CCC2(C1(C(=O)C=C(C2C)C3CCC(C4=C3C(=O)C5(C(CCC5(C4C)C)C)C(=O)OC)O)C(=O)OC)C","Ingredient_weight": "540.7 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "2432","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "10626281","DrugBank_id": "NA"}

(3z)-7-(acetyloxy)-3-(10-hydroxy-6,10-dimethyl-3-oxoundeca-4,6,8-trien-2-ylidene)-3a,6,9a-trimethyl-2-oxo-octahydrocyclopenta[a]naphthalene-6-carboxylic acid

(e,2e,4e,6r,7r,8s,9r,10e)-7,9-dimethoxy-n-[(1z)-5-[(2-methoxy-2-oxoethyl)-c-hydroxycarbonimidoyl]pent-1-en-1-yl]-3,6,8-trimethyl-11-phenylundeca-2,4,10-trienimidic acid

(1r,2s,4s,6r,7s,10s,11r,18r)-7,11-dimethyl-14-oxo-6-[(1r)-1-[(3r,5s)-1,5,6,6-tetramethyl-2,7,8-trioxabicyclo[3.2.1]octan-3-yl]ethyl]-5-oxapentacyclo[8.8.0.0²,⁷.0⁴,⁶.0¹¹,¹⁶]octadeca-12,15-dien-18-yl acetate

(1r,2s,4s,6r,7s,10s,11r,18r)-7,11-dimethyl-14-oxo-6-[(1r)-1-[(3r,5s)-1,5,6,6-tetramethyl-2,7,8-trioxabicyclo[3.2.1]octan-3-yl]ethyl]-5-oxapentacyclo[8.8.0.0²,⁷.0⁴,⁶.0¹¹,¹⁶]octadeca-12,15-dien-18-yl acetate

16-[1-hydroxy-1-(5-methyl-6-oxo-2,3-dihydropyran-2-yl)ethyl]-8,8,13,17-tetramethyl-6-oxo-7-oxapentacyclo[10.7.0.0¹,³.0³,⁹.0¹³,¹⁷]nonadec-4-en-18-yl acetate

(1s,4s,5r,6r,9s,10r,12r,14r)-6-(acetyloxy)-5-hydroxy-7-(hydroxymethyl)-3,11,11,14-tetramethyl-15-oxotetracyclo[7.5.1.0¹,⁵.0¹⁰,¹²]pentadeca-2,7-dien-4-yl (2e,4z)-deca-2,4-dienoate

7-[(acetyloxy)methyl]-5,6-dihydroxy-3,11,11,14-tetramethyl-15-oxotetracyclo[7.5.1.0¹,⁵.0¹⁰,¹²]pentadeca-2,7-dien-4-yl deca-2,4-dienoate

(2r,3r)-2,3-bis(2h-1,3-benzodioxol-5-ylmethyl)-4-hydroxybutyl dodecanoate

7,11-dimethyl-14-oxo-6-(1-{1,5,6,6-tetramethyl-2,7,8-trioxabicyclo[3.2.1]octan-3-yl}ethyl)-5-oxapentacyclo[8.8.0.0²,⁷.0⁴,⁶.0¹¹,¹⁶]octadeca-12,15-dien-18-yl acetate

(1s,4s,5r,6r,9s,10r,12r,14r)-6-(acetyloxy)-5-hydroxy-7-(hydroxymethyl)-3,11,11,14-tetramethyl-15-oxotetracyclo[7.5.1.0¹,⁵.0¹⁰,¹²]pentadeca-2,7-dien-4-yl deca-2,4-dienoate

(1s,4s,5s,6r,9s,10r,12r,14r)-7-[(acetyloxy)methyl]-5,6-dihydroxy-3,11,11,14-tetramethyl-15-oxotetracyclo[7.5.1.0¹,⁵.0¹⁰,¹²]pentadeca-2,7-dien-4-yl deca-2,4-dienoate

(1r,3ar,3br,4r,9ar,9bs,11as)-9a,11a-dimethyl-2,7-dioxo-1-[(1s)-1-[(1s,3r,5r)-1,5,6,6-tetramethyl-2,7,8-trioxabicyclo[3.2.1]octan-3-yl]ethyl]-1h,3h,3ah,3bh,4h,5h,9bh,10h,11h-cyclopenta[a]phenanthren-4-yl acetate

(1r,3ar,3br,4r,9ar,9bs,11as)-9a,11a-dimethyl-2,7-dioxo-1-[(1s)-1-[(1s,3r,5r)-1,5,6,6-tetramethyl-2,7,8-trioxabicyclo[3.2.1]octan-3-yl]ethyl]-1h,3h,3ah,3bh,4h,5h,9bh,10h,11h-cyclopenta[a]phenanthren-4-yl acetate

2-[(3r,3ar,6r,7r,9br)-3-[(1s)-1-[(2r,3s)-3-hydroxy-5-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-3a,9b-dimethyl-6'-oxo-1,2,3,4,7,8-hexahydrospiro[cyclopenta[a]naphthalene-6,3'-oxan]-7-yl]propan-2-yl acetate

2-[(3r,3ar,6r,7r,9br)-3-[(1s)-1-[(2r,3s)-3-hydroxy-5-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-3a,9b-dimethyl-6'-oxo-1,2,3,4,7,8-hexahydrospiro[cyclopenta[a]naphthalene-6,3'-oxan]-7-yl]propan-2-yl acetate

1-(2-aminophenyl)-2-{[(1s,2r,3r,4s,5r,6s,8s,9s,10r,13s,16s,17s)-11-ethyl-8-hydroxy-4,6,16-trimethoxy-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-13-yl]oxy}ethanone

3',3a,4'',6,6,9a,11a-heptamethyl-5'',7,10-trioxo-2,3,4,5,5a,8,9,11-octahydrodispiro[cyclopenta[a]phenanthrene-1,2':5',2''-bis(oxolane)]-3-yl acetate

(1s,4s,5r,6r,9s,10r,12r,14r)-7-[(acetyloxy)methyl]-4,5-dihydroxy-3,11,11,14-tetramethyl-15-oxotetracyclo[7.5.1.0¹,⁵.0¹⁰,¹²]pentadeca-2,7-dien-6-yl (2e,4z)-deca-2,4-dienoate

(1'r,2r,4's,5s,6r,8'r,10'z,13'r,14'z,16'z,20'r,24's)-6-ethyl-24'-hydroxy-5,11',13',22'-tetramethyl-3',7',19'-trioxaspiro[oxane-2,6'-tetracyclo[15.6.1.1⁴,⁸.0²⁰,²⁴]pentacosane]-10',14',16',22'-tetraene-2',21'-dione

(1'r,2r,4's,5s,6r,8'r,10'z,13'r,14'z,16'z,20'r,24's)-6-ethyl-24'-hydroxy-5,11',13',22'-tetramethyl-3',7',19'-trioxaspiro[oxane-2,6'-tetracyclo[15.6.1.1⁴,⁸.0²⁰,²⁴]pentacosane]-10',14',16',22'-tetraene-2',21'-dione

7,9-bis(acetyloxy)-1-(furan-3-yl)-3b,6,6,9a,11a-pentamethyl-1h,2h,4h,5h,5ah,7h,8h,9h,9bh,10h,11h-cyclopenta[a]phenanthren-4-yl acetate

[(2r,8r,12r,15r,16r)-15-[(1s)-1-[(2r,3s)-3-hydroxy-5-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-7,7,12,16-tetramethyl-5-oxo-6-oxatetracyclo[9.7.0.0²,⁸.0¹²,¹⁶]octadeca-1(18),10-dien-2-yl]methyl acetate

[(2r,8r,12r,15r,16r)-15-[(1s)-1-[(2r,3s)-3-hydroxy-5-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-7,7,12,16-tetramethyl-5-oxo-6-oxatetracyclo[9.7.0.0²,⁸.0¹²,¹⁶]octadeca-1(18),10-dien-2-yl]methyl acetate

(1r,3s,9r,12s,13s,16s,17r,18s)-16-[(1r)-1-hydroxy-1-[(2s)-5-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-8,8,13,17-tetramethyl-6-oxo-7-oxapentacyclo[10.7.0.0¹,³.0³,⁹.0¹³,¹⁷]nonadec-4-en-18-yl acetate

(1r,3s,9r,12s,13s,16s,17r,18s)-16-[(1r)-1-hydroxy-1-[(2s)-5-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-8,8,13,17-tetramethyl-6-oxo-7-oxapentacyclo[10.7.0.0¹,³.0³,⁹.0¹³,¹⁷]nonadec-4-en-18-yl acetate

7-[(acetyloxy)methyl]-4,5-dihydroxy-3,11,11,14-tetramethyl-15-oxotetracyclo[7.5.1.0¹,⁵.0¹⁰,¹²]pentadeca-2,7-dien-6-yl (2e)-deca-2,4-dienoate

methyl (3r,3ar,7r,7as)-6-[(3r,3ar,5r,8r,9s,9as)-8-hydroxy-3a-(methoxycarbonyl)-3,9,9a-trimethyl-4-oxo-1h,2h,3h,5h,6h,7h,8h,9h-cyclopenta[b]naphthalen-5-yl]-3,7,7a-trimethyl-4-oxo-1,2,3,7-tetrahydroindene-3a-carboxylate

methyl (3r,3ar,7r,7as)-6-[(3r,3ar,5r,8r,9s,9as)-8-hydroxy-3a-(methoxycarbonyl)-3,9,9a-trimethyl-4-oxo-1h,2h,3h,5h,6h,7h,8h,9h-cyclopenta[b]naphthalen-5-yl]-3,7,7a-trimethyl-4-oxo-1,2,3,7-tetrahydroindene-3a-carboxylate

(1s,4s,5s,6r,9r,10r,12r,14r)-7-[(acetyloxy)methyl]-5,6-dihydroxy-3,11,11,14-tetramethyl-15-oxotetracyclo[7.5.1.0¹,⁵.0¹⁰,¹²]pentadeca-2,7-dien-4-yl (2z,4e)-deca-2,4-dienoate

(1'r,2r,4's,5s,6r,8'r,10'e,13'r,14'e,16'e,20's,24's)-6-ethyl-24'-hydroxy-5,11',13',22'-tetramethyl-3',7',19'-trioxaspiro[oxane-2,6'-tetracyclo[15.6.1.1⁴,⁸.0²⁰,²⁴]pentacosane]-10',14',16',22'-tetraene-2',21'-dione

(1'r,2r,4's,5s,6r,8'r,10'e,13'r,14'e,16'e,20's,24's)-6-ethyl-24'-hydroxy-5,11',13',22'-tetramethyl-3',7',19'-trioxaspiro[oxane-2,6'-tetracyclo[15.6.1.1⁴,⁸.0²⁰,²⁴]pentacosane]-10',14',16',22'-tetraene-2',21'-dione

(1s,4s,5s,6r,9s,10r,12r,14r)-7-[(acetyloxy)methyl]-5,6-dihydroxy-3,11,11,14-tetramethyl-15-oxotetracyclo[7.5.1.0¹,⁵.0¹⁰,¹²]pentadeca-2,7-dien-4-yl (2e,4z)-deca-2,4-dienoate

(1s,3s,3'r,3as,4''s,5's,5ar,9as,11as)-3',3a,4'',6,6,9a,11a-heptamethyl-5'',7,10-trioxo-2,3,4,5,5a,8,9,11-octahydrodispiro[cyclopenta[a]phenanthrene-1,2':5',2''-bis(oxolane)]-3-yl acetate

methyl (3r,3ar,7r,7as)-6-[(3r,3ar,5s,8r,9s,9as)-8-hydroxy-3a-(methoxycarbonyl)-3,9,9a-trimethyl-4-oxo-1h,2h,3h,5h,6h,7h,8h,9h-cyclopenta[b]naphthalen-5-yl]-3,7,7a-trimethyl-4-oxo-1,2,3,7-tetrahydroindene-3a-carboxylate

methyl (3r,3ar,7r,7as)-6-[(3r,3ar,5s,8r,9s,9as)-8-hydroxy-3a-(methoxycarbonyl)-3,9,9a-trimethyl-4-oxo-1h,2h,3h,5h,6h,7h,8h,9h-cyclopenta[b]naphthalen-5-yl]-3,7,7a-trimethyl-4-oxo-1,2,3,7-tetrahydroindene-3a-carboxylate

(1r,4r,5r,6s,9r,10s,12s,14s)-7-[(acetyloxy)methyl]-5,6-dihydroxy-3,11,11,14-tetramethyl-15-oxotetracyclo[7.5.1.0¹,⁵.0¹⁰,¹²]pentadeca-2,7-dien-4-yl (2z,4e)-deca-2,4-dienoate

ethyl 6-{4-hydroxy-3a,6,6,9a,11a-pentamethyl-3,7,10-trioxo-1h,2h,4h,5h,5ah,8h,9h,11h-cyclopenta[a]phenanthren-1-yl}-2-methyl-4-oxohept-5-enoate

9a,11a-dimethyl-2,7-dioxo-1-(1-{1,5,6,6-tetramethyl-2,7,8-trioxabicyclo[3.2.1]octan-3-yl}ethyl)-1h,3h,3ah,3bh,4h,5h,9bh,10h,11h-cyclopenta[a]phenanthren-4-yl acetate

ethyl (5e)-6-[(1r,3ar,4s,5ar,9as,11ar)-4-hydroxy-3a,6,6,9a,11a-pentamethyl-3,7,10-trioxo-1h,2h,4h,5h,5ah,8h,9h,11h-cyclopenta[a]phenanthren-1-yl]-2-methyl-4-oxohept-5-enoate

16-(acetyloxy)-2,9,13,17-tetramethyl-7-(4-methyl-2-oxopent-3-en-1-yl)-6-oxo-5-oxapentacyclo[10.8.0.0²,⁹.0⁴,⁸.0¹³,¹⁸]icos-1(20)-ene-17-carboxylic acid

(1s,4s,5s,6r,9s,10r,12r,14r)-7-[(acetyloxy)methyl]-5,6-dihydroxy-3,11,11,14-tetramethyl-15-oxotetracyclo[7.5.1.0¹,⁵.0¹⁰,¹²]pentadeca-2,7-dien-4-yl (2e,4e)-deca-2,4-dienoate

1-(2-aminophenyl)-2-({11-ethyl-8-hydroxy-4,6,16-trimethoxy-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-13-yl}oxy)ethanone

(1r,2s,4s,6r,7s,10s,11r,18r)-7,11-dimethyl-14-oxo-6-[(1r)-1-[(1s,3r,5r)-1,5,6,6-tetramethyl-2,7,8-trioxabicyclo[3.2.1]octan-3-yl]ethyl]-5-oxapentacyclo[8.8.0.0²,⁷.0⁴,⁶.0¹¹,¹⁶]octadeca-12,15-dien-18-yl acetate

(1r,2s,4s,6r,7s,10s,11r,18r)-7,11-dimethyl-14-oxo-6-[(1r)-1-[(1s,3r,5r)-1,5,6,6-tetramethyl-2,7,8-trioxabicyclo[3.2.1]octan-3-yl]ethyl]-5-oxapentacyclo[8.8.0.0²,⁷.0⁴,⁶.0¹¹,¹⁶]octadeca-12,15-dien-18-yl acetate

(1s,2r,4s,5r,6r,7s,9r)-5-(acetyloxy)-2,6,10,10-tetramethyl-7-{[(2e)-3-phenylprop-2-enoyl]oxy}-11-oxatricyclo[7.2.1.0¹,⁶]dodecan-4-yl hexanoate

(2r)-2-(acetyloxy)-2-[(1r,3r,4s)-3-hydroxy-4-[(9r,13r,17r)-8,8,13,17-tetramethyl-6-oxo-7-oxatetracyclo[10.7.0.0³,⁹.0¹³,¹⁷]nonadeca-1(12),2,4-trien-16-yl]cyclopentyl]propanoic acid

[(1r,2s,8r,12r,15r,16r,18r)-7,7,12,16-tetramethyl-15-[(1s)-1-[(2s)-5-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-5-oxo-6,19-dioxapentacyclo[9.8.0.0¹,¹⁸.0²,⁸.0¹²,¹⁶]nonadec-10-en-2-yl]methyl acetate

[(1r,2s,8r,12r,15r,16r,18r)-7,7,12,16-tetramethyl-15-[(1s)-1-[(2s)-5-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-5-oxo-6,19-dioxapentacyclo[9.8.0.0¹,¹⁸.0²,⁸.0¹²,¹⁶]nonadec-10-en-2-yl]methyl acetate