Exact Mass: 444.2584

Exact Mass Matches: 444.2584

Found 211 metabolites which its exact mass value is equals to given mass value 444.2584, within given mass tolerance error 0.01 dalton. Try search metabolite list with more accurate mass tolerance error 0.001 dalton.

Bufotalin

[(3S,5R,8R,9S,10S,13R,14S,16S,17R)-3,14-dihydroxy-10,13-dimethyl-17-(6-oxopyran-3-yl)-1,2,3,4,5,6,7,8,9,11,12,15,16,17-tetradecahydrocyclopenta[a]phenanthren-16-yl] acetate

C26H36O6 (444.2512)


Bufotalin is a steroid lactone. It is functionally related to a bufanolide. Bufotalin is a natural product found in Bufo gargarizans, Duttaphrynus melanostictus Bufotalin is a cardiotoxic bufanolide steroid, cardiac glycoside analogue, secreted by a number of toad species.[2][3] Bufotalin can be extracted from the skin parotoid glands of several types of toad. Rhinella marina (Cane toad), Rhaebo guttatus (Smooth-sided toad), Bufo melanostictus (Asian toad), and Bufo bufo (common European toad) are sources of bufotalin. Traditional medicine Bufotalin is part of Ch'an Su, a traditional Chinese medicine used for cancer. It is also known as Venenum Bufonis or senso (Japanese).[5] Toxicity Specifically, in cats the lethal median dose is 0.13 mg/kg.[1] and in dogs is 0.36 mg/kg (intravenous).[6] Knowing this it is advisable to monitor those functions continuously using an EKG. As there is no antidote against bufotalin all occurring symptoms need to be treated separately or if possible in combination with others. To increase the clearance theoretically, due to the similarities with digitoxin, cholestyramine, a bile salt, might help.[6] Recent animal studies have shown that taurine restores cardiac functions.[7] Symptomatic measures include lignocaine, atropine and phenytoin for cardiac toxicity and intravenous potassium compounds to correct hyperkalaemia from its effect on the Na+/K+ ATPase pump.[6] Pharmacology and mechanism of action After a single intravenous injection, bufotalin gets quickly distributed and eliminated from the blood plasma with a half-time of 28.6 minutes and a MRT of 14.7 min. After 30 minutes after an administration of bufotalin, the concentrations within the brain and lungs are significantly higher than those in blood and other tissues.[8] It also increases cancer cell's susceptibility to apoptosis via TNF-α signalling by the BH3 interacting domain death agonist and STAT proteins.[9] Bufotalin induces apoptosis in vitro in human hepatocellular carcinoma Hep 3B cells and might involve caspases and apoptosis inducing factor (AIF).[10] The use of bufotalin as a cancer treating compound is still in the experimental phase. It also arrests cell cycle at G(2)/M, by up- and down- regulation of several enzymes. Bufotalin. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. https://commonchemistry.cas.org/detail?cas_rn=471-95-4 (retrieved 2024-06-29) (CAS RN: 471-95-4). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0). Bufotalin is a steroid lactone isolated from Venenum Bufonis with potently antitumor activities. Bufotalin induces cancer cell apoptosis and also induces endoplasmic reticulum (ER) stress activation[1][2]. Bufotalin is a steroid lactone isolated from Venenum Bufonis with potently antitumor activities. Bufotalin induces cancer cell apoptosis and also induces endoplasmic reticulum (ER) stress activation[1][2].

   

sn-3-O-(geranylgeranyl)glycerol 1-phosphate

(2S)-2-hydroxy-3-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-yloxy]propyl phosphate

C23H41O6P (444.2641)


   

Antibiotic GR 95647X

2,4,6-trihydroxy-5-(1-{5-hydroxy-1,1,3-trimethyl-decahydrocyclopropa[e]inden-3-yl}-3-methylbutyl)benzene-1,3-dicarbaldehyde

C26H36O6 (444.2512)


Antibiotic GR 95647X is a constituent of Eucalyptus globulus (Tasmanian blue gum). Constituent of Eucalyptus globulus (Tasmanian blue gum).

   

Bufotalin

5,11-Dihydroxy-2,15-dimethyl-14-(2-oxo-2H-pyran-5-yl)tetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadecan-13-yl acetic acid

C26H36O6 (444.2512)


   

SCHEMBL12713715

SCHEMBL12713715

C23H41O6P (444.2641)


   

15-O-Methyl-18-oxoneovibsanin F

(+)-15-O-Methyl-18-oxoneovibsanin F

C26H36O6 (444.2512)


   

SCHEMBL12713580

SCHEMBL12713580

C23H41O6P (444.2641)


   
   

hanliuin III

hanliuin III

C26H36O6 (444.2512)


   

Difurocumenone

Difurocumenone

C30H36O3 (444.2664)


   

8,20-Diacetoxyserrulat-14-en-7-yl acetate

8,20-Diacetoxyserrulat-14-en-7-yl acetate

C26H36O6 (444.2512)


   

Apoastacenal

Apoastacenal

C30H36O3 (444.2664)


   

eremoxylarin B

eremoxylarin B

C26H36O6 (444.2512)


   

(+)-adociacetylene B

(+)-adociacetylene B

C30H36O3 (444.2664)


   

1-[O-2-(2-methyldecanoyl)] murrangatin|paniculacin

1-[O-2-(2-methyldecanoyl)] murrangatin|paniculacin

C26H36O6 (444.2512)


   

4-Hydroxy-2-[13-(3,4-methylenedioxyphenyl)tridecanoyl]cyclohexane-1,3-dione

4-Hydroxy-2-[13-(3,4-methylenedioxyphenyl)tridecanoyl]cyclohexane-1,3-dione

C26H36O6 (444.2512)


   

virgaurin B

virgaurin B

C30H36O3 (444.2664)


   

15beta-acetyloxybufalin

15beta-acetyloxybufalin

C26H36O6 (444.2512)


   

Cylindrol A

Cylindrol A

C26H36O6 (444.2512)


   

2-[13-(1,3-Benzodioxole-5-yl)tridecanoyl]-3,6-dihydroxy-2-cyclohexene-1-one

2-[13-(1,3-Benzodioxole-5-yl)tridecanoyl]-3,6-dihydroxy-2-cyclohexene-1-one

C26H36O6 (444.2512)


   

(1S)-O4-(4-methyl-3-methylamino-beta-L-3-deoxy-arabinopyranosyl)-O6-(6-methyl-2-oxa-5-aza-bicyclo[2.2.2]oct-5-en-3-yl)-2-deoxy-streptamine|Gentamicin I-1

(1S)-O4-(4-methyl-3-methylamino-beta-L-3-deoxy-arabinopyranosyl)-O6-(6-methyl-2-oxa-5-aza-bicyclo[2.2.2]oct-5-en-3-yl)-2-deoxy-streptamine|Gentamicin I-1

C20H36N4O7 (444.2584)


   

espinasanolide-(angelate) methyl ester|espinasanolide- methyl ester

espinasanolide-(angelate) methyl ester|espinasanolide- methyl ester

C26H36O6 (444.2512)


   

funiculide D

funiculide D

C26H36O6 (444.2512)


   

Dicadalenol|rel-1beta,7-Dihydroxy-2betaH-1,2,3,4-tetrahydro-14,8,2(O),7-dicadalenol

Dicadalenol|rel-1beta,7-Dihydroxy-2betaH-1,2,3,4-tetrahydro-14,8,2(O),7-dicadalenol

C30H36O3 (444.2664)


   

4-Oxo-4,4-diapocaroten-4-oic acid

4-Oxo-4,4-diapocaroten-4-oic acid

C30H36O3 (444.2664)


   
   

Ile Leu Ala Asp

Ile Leu Ala Asp

C20H36N4O7 (444.2584)


   

Ala Val Leu Glu

Ala Val Leu Glu

C20H36N4O7 (444.2584)


   

Leu Val Ala Glu

Leu Val Ala Glu

C20H36N4O7 (444.2584)


   

Ala Ile Leu Asp

Ala Ile Leu Asp

C20H36N4O7 (444.2584)


   

Ala Glu Ile Ile

(2S,3S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-4-carboxybutanamido]-3-methylpentanamido]-3-methylpentanoic acid

C20H36N4O7 (444.2584)


   

Ala Glu Ile Leu

(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-4-carboxybutanamido]-3-methylpentanamido]-4-methylpentanoic acid

C20H36N4O7 (444.2584)


   

Ala Glu Leu Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-4-carboxybutanamido]-4-methylpentanamido]-3-methylpentanoic acid

C20H36N4O7 (444.2584)


   

Ala Glu Leu Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-4-carboxybutanamido]-4-methylpentanamido]-4-methylpentanoic acid

C20H36N4O7 (444.2584)


   

Ala Ile Glu Ile

(2S,3S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-aminopropanamido]-3-methylpentanamido]-4-carboxybutanamido]-3-methylpentanoic acid

C20H36N4O7 (444.2584)


   

Ala Ile Glu Leu

(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-aminopropanamido]-3-methylpentanamido]-4-carboxybutanamido]-4-methylpentanoic acid

C20H36N4O7 (444.2584)


   

Ala Ile Ile Glu

(2S)-2-[(2S,3S)-2-[(2S,3S)-2-[(2S)-2-aminopropanamido]-3-methylpentanamido]-3-methylpentanamido]pentanedioic acid

C20H36N4O7 (444.2584)


   

Ala Ile Leu Glu

(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-aminopropanamido]-3-methylpentanamido]-4-methylpentanamido]pentanedioic acid

C20H36N4O7 (444.2584)


   

Ala Leu Glu Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-4-methylpentanamido]-4-carboxybutanamido]-3-methylpentanoic acid

C20H36N4O7 (444.2584)


   

Ala Leu Glu Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-4-methylpentanamido]-4-carboxybutanamido]-4-methylpentanoic acid

C20H36N4O7 (444.2584)


   

Ala Leu Ile Glu

(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-4-methylpentanamido]-3-methylpentanamido]pentanedioic acid

C20H36N4O7 (444.2584)


   

Ala Leu Leu Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-aminopropanamido]-4-methylpentanamido]-4-methylpentanamido]pentanedioic acid

C20H36N4O7 (444.2584)


   

Asp Ile Val Val

(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-methylpentanamido]-3-methylbutanamido]-3-methylbutanoic acid

C20H36N4O7 (444.2584)


   

Asp Leu Val Val

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-4-methylpentanamido]-3-methylbutanamido]-3-methylbutanoic acid

C20H36N4O7 (444.2584)


   

Asp Val Ile Val

(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-methylbutanamido]-3-methylpentanamido]-3-methylbutanoic acid

C20H36N4O7 (444.2584)


   

Asp Val Leu Val

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-methylbutanamido]-4-methylpentanamido]-3-methylbutanoic acid

C20H36N4O7 (444.2584)


   

Asp Val Val Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-methylbutanamido]-3-methylbutanamido]-3-methylpentanoic acid

C20H36N4O7 (444.2584)


   

Asp Val Val Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-methylbutanamido]-3-methylbutanamido]-4-methylpentanoic acid

C20H36N4O7 (444.2584)


   

Glu Ala Ile Ile

(2S,3S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]propanamido]-3-methylpentanamido]-3-methylpentanoic acid

C20H36N4O7 (444.2584)


   

Glu Ala Ile Leu

(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]propanamido]-3-methylpentanamido]-4-methylpentanoic acid

C20H36N4O7 (444.2584)


   

Glu Ala Leu Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]propanamido]-4-methylpentanamido]-3-methylpentanoic acid

C20H36N4O7 (444.2584)


   

Glu Ala Leu Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]propanamido]-4-methylpentanamido]-4-methylpentanoic acid

C20H36N4O7 (444.2584)


   

Glu Ile Ala Ile

(2S,3S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-amino-4-carboxybutanamido]-3-methylpentanamido]propanamido]-3-methylpentanoic acid

C20H36N4O7 (444.2584)


   

Glu Ile Ala Leu

(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-amino-4-carboxybutanamido]-3-methylpentanamido]propanamido]-4-methylpentanoic acid

C20H36N4O7 (444.2584)


   

Glu Ile Ile Ala

(4S)-4-amino-4-{[(1S,2S)-1-{[(1S,2S)-1-{[(1S)-1-carboxyethyl]carbamoyl}-2-methylbutyl]carbamoyl}-2-methylbutyl]carbamoyl}butanoic acid

C20H36N4O7 (444.2584)


   

Glu Ile Leu Ala

(4S)-4-amino-4-{[(1S,2S)-1-{[(1S)-1-{[(1S)-1-carboxyethyl]carbamoyl}-3-methylbutyl]carbamoyl}-2-methylbutyl]carbamoyl}butanoic acid

C20H36N4O7 (444.2584)


   

Glu Leu Ala Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]-4-methylpentanamido]propanamido]-3-methylpentanoic acid

C20H36N4O7 (444.2584)


   

Glu Leu Ala Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]-4-methylpentanamido]propanamido]-4-methylpentanoic acid

C20H36N4O7 (444.2584)


   

Glu Leu Ile Ala

(4S)-4-amino-4-{[(1S)-1-{[(1S,2S)-1-{[(1S)-1-carboxyethyl]carbamoyl}-2-methylbutyl]carbamoyl}-3-methylbutyl]carbamoyl}butanoic acid

C20H36N4O7 (444.2584)


   

Glu Leu Leu Ala

(4S)-4-amino-4-{[(1S)-1-{[(1S)-1-{[(1S)-1-carboxyethyl]carbamoyl}-3-methylbutyl]carbamoyl}-3-methylbutyl]carbamoyl}butanoic acid

C20H36N4O7 (444.2584)


   

Glu Val Val Val

(4S)-4-amino-4-{[(1S)-1-{[(1S)-1-{[(1S)-1-carboxy-2-methylpropyl]carbamoyl}-2-methylpropyl]carbamoyl}-2-methylpropyl]carbamoyl}butanoic acid

C20H36N4O7 (444.2584)


   

Gly Gly Arg Arg

(2S)-2-[(2S)-2-[2-(2-aminoacetamido)acetamido]-5-carbamimidamidopentanamido]-5-carbamimidamidopentanoic acid

C16H32N10O5 (444.2557)


   

Gly Arg Gly Arg

(2S)-2-{2-[(2S)-2-(2-aminoacetamido)-5-carbamimidamidopentanamido]acetamido}-5-carbamimidamidopentanoic acid

C16H32N10O5 (444.2557)


   

Gly Arg Arg Gly

2-[(2S)-2-[(2S)-2-(2-aminoacetamido)-5-carbamimidamidopentanamido]-5-carbamimidamidopentanamido]acetic acid

C16H32N10O5 (444.2557)


   

Ile Ala Glu Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]propanamido]-4-carboxybutanamido]-3-methylpentanoic acid

C20H36N4O7 (444.2584)


   

Ile Ala Glu Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]propanamido]-4-carboxybutanamido]-4-methylpentanoic acid

C20H36N4O7 (444.2584)


   

Ile Ala Ile Glu

(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]propanamido]-3-methylpentanamido]pentanedioic acid

C20H36N4O7 (444.2584)


   

Ile Ala Leu Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]propanamido]-4-methylpentanamido]pentanedioic acid

C20H36N4O7 (444.2584)


   

Ile Asp Val Val

(2S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-3-carboxypropanamido]-3-methylbutanamido]-3-methylbutanoic acid

C20H36N4O7 (444.2584)


   

Ile Glu Ala Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-4-carboxybutanamido]propanamido]-3-methylpentanoic acid

C20H36N4O7 (444.2584)


   

Ile Glu Ala Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-4-carboxybutanamido]propanamido]-4-methylpentanoic acid

C20H36N4O7 (444.2584)


   

Ile Glu Ile Ala

(4S)-4-[(2S,3S)-2-amino-3-methylpentanamido]-4-{[(1S,2S)-1-{[(1S)-1-carboxyethyl]carbamoyl}-2-methylbutyl]carbamoyl}butanoic acid

C20H36N4O7 (444.2584)


   

Ile Glu Leu Ala

(4S)-4-[(2S,3S)-2-amino-3-methylpentanamido]-4-{[(1S)-1-{[(1S)-1-carboxyethyl]carbamoyl}-3-methylbutyl]carbamoyl}butanoic acid

C20H36N4O7 (444.2584)


   

Ile Ile Ala Glu

(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-3-methylpentanamido]propanamido]pentanedioic acid

C20H36N4O7 (444.2584)


   

Ile Ile Glu Ala

(4S)-4-[(2S,3S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-3-methylpentanamido]-4-{[(1S)-1-carboxyethyl]carbamoyl}butanoic acid

C20H36N4O7 (444.2584)


   

Ile Leu Ala Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-4-methylpentanamido]propanamido]pentanedioic acid

C20H36N4O7 (444.2584)


   

Ile Leu Glu Ala

(4S)-4-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-4-methylpentanamido]-4-{[(1S)-1-carboxyethyl]carbamoyl}butanoic acid

C20H36N4O7 (444.2584)


   

Ile Val Asp Val

(2S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-3-methylbutanamido]-3-carboxypropanamido]-3-methylbutanoic acid

C20H36N4O7 (444.2584)


   

Ile Val Val Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-3-methylbutanamido]-3-methylbutanamido]butanedioic acid

C20H36N4O7 (444.2584)


   

Leu Ala Glu Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]propanamido]-4-carboxybutanamido]-3-methylpentanoic acid

C20H36N4O7 (444.2584)


   

Leu Ala Glu Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]propanamido]-4-carboxybutanamido]-4-methylpentanoic acid

C20H36N4O7 (444.2584)


   

Leu Ala Ile Glu

(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]propanamido]-3-methylpentanamido]pentanedioic acid

C20H36N4O7 (444.2584)


   

Leu Ala Leu Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]propanamido]-4-methylpentanamido]pentanedioic acid

C20H36N4O7 (444.2584)


   

Leu Asp Val Val

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-3-carboxypropanamido]-3-methylbutanamido]-3-methylbutanoic acid

C20H36N4O7 (444.2584)


   

Leu Glu Ala Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-4-carboxybutanamido]propanamido]-3-methylpentanoic acid

C20H36N4O7 (444.2584)


   

Leu Glu Ala Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-4-carboxybutanamido]propanamido]-4-methylpentanoic acid

C20H36N4O7 (444.2584)


   

Leu Glu Ile Ala

(4S)-4-[(2S)-2-amino-4-methylpentanamido]-4-{[(1S,2S)-1-{[(1S)-1-carboxyethyl]carbamoyl}-2-methylbutyl]carbamoyl}butanoic acid

C20H36N4O7 (444.2584)


   

Leu Glu Leu Ala

(4S)-4-[(2S)-2-amino-4-methylpentanamido]-4-{[(1S)-1-{[(1S)-1-carboxyethyl]carbamoyl}-3-methylbutyl]carbamoyl}butanoic acid

C20H36N4O7 (444.2584)


   

Leu Ile Ala Glu

(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-amino-4-methylpentanamido]-3-methylpentanamido]propanamido]pentanedioic acid

C20H36N4O7 (444.2584)


   

Leu Ile Glu Ala

(4S)-4-[(2S,3S)-2-[(2S)-2-amino-4-methylpentanamido]-3-methylpentanamido]-4-{[(1S)-1-carboxyethyl]carbamoyl}butanoic acid

C20H36N4O7 (444.2584)


   

Leu Leu Ala Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-4-methylpentanamido]propanamido]pentanedioic acid

C20H36N4O7 (444.2584)


   

Leu Leu Glu Ala

(4S)-4-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-4-methylpentanamido]-4-{[(1S)-1-carboxyethyl]carbamoyl}butanoic acid

C20H36N4O7 (444.2584)


   

Leu Val Asp Val

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-3-methylbutanamido]-3-carboxypropanamido]-3-methylbutanoic acid

C20H36N4O7 (444.2584)


   

Leu Val Val Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-3-methylbutanamido]-3-methylbutanamido]butanedioic acid

C20H36N4O7 (444.2584)


   
   
   

Arg Gly Gly Arg

(2S)-2-(2-{2-[(2S)-2-amino-5-carbamimidamidopentanamido]acetamido}acetamido)-5-carbamimidamidopentanoic acid

C16H32N10O5 (444.2557)


   

Arg Gly Arg Gly

2-[(2S)-2-{2-[(2S)-2-amino-5-carbamimidamidopentanamido]acetamido}-5-carbamimidamidopentanamido]acetic acid

C16H32N10O5 (444.2557)


   

Arg Arg Gly Gly

2-{2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-5-carbamimidamidopentanamido]acetamido}acetic acid

C16H32N10O5 (444.2557)


   

Val Asp Ile Val

(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]-3-carboxypropanamido]-3-methylpentanamido]-3-methylbutanoic acid

C20H36N4O7 (444.2584)


   

Val Asp Leu Val

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]-3-carboxypropanamido]-4-methylpentanamido]-3-methylbutanoic acid

C20H36N4O7 (444.2584)


   

Val Asp Val Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]-3-carboxypropanamido]-3-methylbutanamido]-3-methylpentanoic acid

C20H36N4O7 (444.2584)


   

Val Asp Val Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]-3-carboxypropanamido]-3-methylbutanamido]-4-methylpentanoic acid

C20H36N4O7 (444.2584)


   

Val Glu Val Val

(4S)-4-[(2S)-2-amino-3-methylbutanamido]-4-{[(1S)-1-{[(1S)-1-carboxy-2-methylpropyl]carbamoyl}-2-methylpropyl]carbamoyl}butanoic acid

C20H36N4O7 (444.2584)


   

Val Ile Asp Val

(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-amino-3-methylbutanamido]-3-methylpentanamido]-3-carboxypropanamido]-3-methylbutanoic acid

C20H36N4O7 (444.2584)


   

Val Ile Val Asp

(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-amino-3-methylbutanamido]-3-methylpentanamido]-3-methylbutanamido]butanedioic acid

C20H36N4O7 (444.2584)


   

Val Leu Asp Val

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]-4-methylpentanamido]-3-carboxypropanamido]-3-methylbutanoic acid

C20H36N4O7 (444.2584)


   

Val Leu Val Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]-4-methylpentanamido]-3-methylbutanamido]butanedioic acid

C20H36N4O7 (444.2584)


   

Val Val Asp Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]-3-methylbutanamido]-3-carboxypropanamido]-3-methylpentanoic acid

C20H36N4O7 (444.2584)


   

Val Val Asp Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]-3-methylbutanamido]-3-carboxypropanamido]-4-methylpentanoic acid

C20H36N4O7 (444.2584)


   

Val Val Glu Val

(4S)-4-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]-3-methylbutanamido]-4-{[(1S)-1-carboxy-2-methylpropyl]carbamoyl}butanoic acid

C20H36N4O7 (444.2584)


   

Val Val Ile Asp

(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]-3-methylbutanamido]-3-methylpentanamido]butanedioic acid

C20H36N4O7 (444.2584)


   

Val Val Leu Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]-3-methylbutanamido]-4-methylpentanamido]butanedioic acid

C20H36N4O7 (444.2584)


   

Val Val Val Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]-3-methylbutanamido]-3-methylbutanamido]pentanedioic acid

C20H36N4O7 (444.2584)


   

AL 8810 isopropyl ester

9α,15R-dihydroxy-11β-fluoro-15-(2,3-dihydro-1H-inden-2-yl)-16,17,18,19,20-pentanor-prosta-5Z,13E-dien-1-oic acid, isopropyl ester

C27H37FO4 (444.2676)


   

GR 95647X

2,4,6-trihydroxy-5-(1-{4-hydroxy-2,6,6-trimethyl-decahydrocyclopropa[e]inden-2-yl}-3-methylbutyl)benzene-1,3-dicarbaldehyde

C26H36O6 (444.2512)


   

LPA O-20:4

(2S)-2-hydroxy-3-[(2E,6E,10E)-3,7,11,15-tetramethylhexadeca-2,6,10,14-tetraen-1-yloxy]propyl phosphate

C23H41O6P (444.2641)


   

Bufotaline

3alpha,14beta-dihydroxy-16beta-acetoxy-5beta-bufa-20,22-dienolide

C26H36O6 (444.2512)


   

4,4-Diapocaroten-4-al-4-oic acid

4-Oxo-4,4-diapo-psi,psi-caroten-4-oic acid

C30H36O3 (444.2664)


   

Prednival

Prednival

C26H36O6 (444.2512)


C147908 - Hormone Therapy Agent > C548 - Therapeutic Hormone > C1636 - Therapeutic Steroid Hormone C308 - Immunotherapeutic Agent > C574 - Immunosuppressant > C211 - Therapeutic Corticosteroid

   

N-(3-Amino-4-chlorophenyl)-4-(2,4-di-tert-pentylphenoxy)butanamide

N-(3-Amino-4-chlorophenyl)-4-(2,4-di-tert-pentylphenoxy)butanamide

C26H37ClN2O2 (444.2543)


   

Lovastatin hydroxy acid sodium

Lovastatin hydroxy acid sodium

C24H37NaO6 (444.2488)


Lovastatin hydroxy acid sodium (Mevinolinic acid sodium) is a highly potent inhibitor of HMG-CoA reductase with a Ki of 0.6 nM[1].

   

Prednisolone pivalate

Prednisolone 21-trimethylacetate

C26H36O6 (444.2512)


   

(2E,4E,6E,8E,10E,12E,14E,16E,18E,20E,22E)-2,6,10,15,19,23-hexamethyl-24-oxotetracosa-2,4,6,8,10,12,14,16,18,20,22-undecaenoic acid

(2E,4E,6E,8E,10E,12E,14E,16E,18E,20E,22E)-2,6,10,15,19,23-hexamethyl-24-oxotetracosa-2,4,6,8,10,12,14,16,18,20,22-undecaenoic acid

C30H36O3 (444.2664)


   

Preaustinoid A

Preaustinoid A

C26H36O6 (444.2512)


A meroterpenoid found in Penicillium rubrum.

   

[(6S)-17-(3,5-dihydroxyphenyl)heptadecan-6-yl] hydrogen sulate

[(6S)-17-(3,5-dihydroxyphenyl)heptadecan-6-yl] hydrogen sulate

C23H40O6S (444.2545)


   

Xyloketal E

Xyloketal E

C26H36O6 (444.2512)


A xyloketal with formula C26H36O6. It was initially isolated from the mangrove fungus Xylaria sp. from the South China sea coast.

   

asnovolin K

asnovolin K

C26H36O6 (444.2512)


A meroterpenoid with formula C26H36O6 isolated from the fungus Aspergillus novofumigatus. It is an intermediate produced in the biosynthetic pathway leading to the synthesis of novofumigatonin.

   

N-[[(8R,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-4-pyridinecarboxamide

N-[[(8R,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-4-pyridinecarboxamide

C22H32N6O4 (444.2485)


   

N-[[(8R,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-4-pyridinecarboxamide

N-[[(8R,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-4-pyridinecarboxamide

C22H32N6O4 (444.2485)


   

N-[[(8R,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methyl-4-pyridinecarboxamide

N-[[(8R,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methyl-4-pyridinecarboxamide

C22H32N6O4 (444.2485)


   

N-[[(8S,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-4-pyridinecarboxamide

N-[[(8S,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-4-pyridinecarboxamide

C22H32N6O4 (444.2485)


   

N-[[(8S,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-4-pyridinecarboxamide

N-[[(8S,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-4-pyridinecarboxamide

C22H32N6O4 (444.2485)


   

N-[[(8R,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-4-pyridinecarboxamide

N-[[(8R,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-4-pyridinecarboxamide

C22H32N6O4 (444.2485)


   

N-[[(8S,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-4-pyridinecarboxamide

N-[[(8S,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-4-pyridinecarboxamide

C22H32N6O4 (444.2485)


   

N-[[(8S,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-4-pyridinecarboxamide

N-[[(8S,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-4-pyridinecarboxamide

C22H32N6O4 (444.2485)


   

N-[[(8S,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methyl-4-pyridinecarboxamide

N-[[(8S,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methyl-4-pyridinecarboxamide

C22H32N6O4 (444.2485)


   

N-[[(8R,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-4-pyridinecarboxamide

N-[[(8R,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,14,15-tetrazabicyclo[10.3.0]pentadeca-12,14-dien-9-yl]methyl]-N-methyl-4-pyridinecarboxamide

C22H32N6O4 (444.2485)


   

N-[[(8S,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methyl-4-pyridinecarboxamide

N-[[(8S,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methyl-4-pyridinecarboxamide

C22H32N6O4 (444.2485)


   
   
   
   

3-O-(geranylgeranyl)glycerol 1-phosphate

3-O-(geranylgeranyl)glycerol 1-phosphate

C23H41O6P (444.2641)


   

Lovastatin Hydroxy Acid

Lovastatin Hydroxy Acid

C24H37NaO6 (444.2488)


   

N-[[(8R,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methyl-4-pyridinecarboxamide

N-[[(8R,9R)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methyl-4-pyridinecarboxamide

C22H32N6O4 (444.2485)


   

N-[[(8S,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methyl-4-pyridinecarboxamide

N-[[(8S,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methyl-4-pyridinecarboxamide

C22H32N6O4 (444.2485)


   

N-[[(8S,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methyl-4-pyridinecarboxamide

N-[[(8S,9R)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methyl-4-pyridinecarboxamide

C22H32N6O4 (444.2485)


   

N-[[(8R,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methyl-4-pyridinecarboxamide

N-[[(8R,9S)-6-[(2S)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methyl-4-pyridinecarboxamide

C22H32N6O4 (444.2485)


   

N-[[(8R,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methyl-4-pyridinecarboxamide

N-[[(8R,9S)-6-[(2R)-1-hydroxypropan-2-yl]-8-methyl-5-oxo-10-oxa-1,6,13,14-tetrazabicyclo[10.2.1]pentadeca-12(15),13-dien-9-yl]methyl]-N-methyl-4-pyridinecarboxamide

C22H32N6O4 (444.2485)


   

sn-1-O-(geranylgeranyl)glycerol 3-phosphate

sn-1-O-(geranylgeranyl)glycerol 3-phosphate

C23H41O6P (444.2641)


   

H-Gly-Arg-Gly-Arg-OH

H-Gly-Arg-Gly-Arg-OH

C16H32N10O5 (444.2557)


   

6-(Isobutyldimethylsilyl)-2-(pentamethyldisilanyl)-5-(trimethylsilyl)naphthalene

6-(Isobutyldimethylsilyl)-2-(pentamethyldisilanyl)-5-(trimethylsilyl)naphthalene

C24H44Si4 (444.252)


   

Antibiotic GR 95647X

Antibiotic GR 95647X

C26H36O6 (444.2512)


   

ST 20:4;O;Hex

ST 20:4;O;Hex

C26H36O6 (444.2512)


   
   

1-[2,4-dihydroxy-6-(2-oxopropyl)phenyl]-11-hydroxy-2,4,6,8,10-pentamethyldodeca-6,8-diene-3,5-dione

1-[2,4-dihydroxy-6-(2-oxopropyl)phenyl]-11-hydroxy-2,4,6,8,10-pentamethyldodeca-6,8-diene-3,5-dione

C26H36O6 (444.2512)


   

8a-hydroxy-3,4a,5-trimethyl-9-[(2-methylbut-2-enoyl)oxy]-4h,5h,6h,7h,8h,9h-naphtho[2,3-b]furan-4-yl 3-methylpent-2-enoate

8a-hydroxy-3,4a,5-trimethyl-9-[(2-methylbut-2-enoyl)oxy]-4h,5h,6h,7h,8h,9h-naphtho[2,3-b]furan-4-yl 3-methylpent-2-enoate

C26H36O6 (444.2512)


   

methyl 14-acetyl-14-hydroxy-2,6,6,10,13-pentamethyl-16-methylidene-7,15-dioxotetracyclo[11.2.1.0²,¹¹.0⁵,¹⁰]hexadecane-1-carboxylate

methyl 14-acetyl-14-hydroxy-2,6,6,10,13-pentamethyl-16-methylidene-7,15-dioxotetracyclo[11.2.1.0²,¹¹.0⁵,¹⁰]hexadecane-1-carboxylate

C26H36O6 (444.2512)


   

10-[4-(acetyloxy)-5-(2-methylprop-1-en-1-yl)-2-oxooxolan-3-ylidene]-3,7-dimethyldeca-2,6-dien-1-yl 2-methylprop-2-enoate

10-[4-(acetyloxy)-5-(2-methylprop-1-en-1-yl)-2-oxooxolan-3-ylidene]-3,7-dimethyldeca-2,6-dien-1-yl 2-methylprop-2-enoate

C26H36O6 (444.2512)


   

[(1r,6s)-6-{[(1s,4as,8as)-5,5,8a-trimethyl-2-methylidene-hexahydro-1h-naphthalen-1-yl]methyl}-2,5-dioxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]methyl (3s)-3-hydroxybutanoate

[(1r,6s)-6-{[(1s,4as,8as)-5,5,8a-trimethyl-2-methylidene-hexahydro-1h-naphthalen-1-yl]methyl}-2,5-dioxo-7-oxabicyclo[4.1.0]hept-3-en-3-yl]methyl (3s)-3-hydroxybutanoate

C26H36O6 (444.2512)


   

5-{10,11-dihydroxy-2,6,15,19-tetramethyl-3,8-dioxatetracyclo[9.8.0.0²,⁷.0¹²,¹⁷]nonadeca-14,18-dien-9-yl}penta-2,4-dienoic acid

5-{10,11-dihydroxy-2,6,15,19-tetramethyl-3,8-dioxatetracyclo[9.8.0.0²,⁷.0¹²,¹⁷]nonadeca-14,18-dien-9-yl}penta-2,4-dienoic acid

C26H36O6 (444.2512)


   

2-[11-(2-methoxypropan-2-yl)-8-methyl-3-oxo-5-(2-oxopropyl)-4-oxatricyclo[6.3.1.0²,⁶]dodec-2(6)-en-7-yl]ethenyl 3-methylbut-2-enoate

2-[11-(2-methoxypropan-2-yl)-8-methyl-3-oxo-5-(2-oxopropyl)-4-oxatricyclo[6.3.1.0²,⁶]dodec-2(6)-en-7-yl]ethenyl 3-methylbut-2-enoate

C26H36O6 (444.2512)


   

(3r,8as)-5-propyl-3-(tetradecyloxy)-1h,8h,8ah-3λ⁵-furo[3,4-e][1,3,2]dioxaphosphepine-3,6-dione

(3r,8as)-5-propyl-3-(tetradecyloxy)-1h,8h,8ah-3λ⁵-furo[3,4-e][1,3,2]dioxaphosphepine-3,6-dione

C23H41O6P (444.2641)


   

(3r,8ar)-3-(hexadecyloxy)-5-methyl-1h,8h,8ah-3λ⁵-furo[3,4-e][1,3,2]dioxaphosphepine-3,6-dione

(3r,8ar)-3-(hexadecyloxy)-5-methyl-1h,8h,8ah-3λ⁵-furo[3,4-e][1,3,2]dioxaphosphepine-3,6-dione

C23H41O6P (444.2641)


   

2-[2,7-dihydroxy-3-methyl-5-(2-oxopropyl)-3,4-dihydro-1-benzopyran-2-yl]-9-hydroxy-4,6,8-trimethyldeca-4,6-dien-3-one

2-[2,7-dihydroxy-3-methyl-5-(2-oxopropyl)-3,4-dihydro-1-benzopyran-2-yl]-9-hydroxy-4,6,8-trimethyldeca-4,6-dien-3-one

C26H36O6 (444.2512)


   

3-(hexadecyloxy)-5-methyl-1h,8h,8ah-3λ⁵-furo[3,4-e][1,3,2]dioxaphosphepine-3,6-dione

3-(hexadecyloxy)-5-methyl-1h,8h,8ah-3λ⁵-furo[3,4-e][1,3,2]dioxaphosphepine-3,6-dione

C23H41O6P (444.2641)


   

15-o-methyl-18-oxoneovibsanin f

NA

C26H36O6 (444.2512)


{"Ingredient_id": "HBIN001711","Ingredient_name": "15-o-methyl-18-oxoneovibsanin f","Alias": "NA","Ingredient_formula": "C26H36O6","Ingredient_Smile": "CC(=CC(=O)OC=CC1C2=C(C3CC1(CCC3C(C)(C)OC)C)C(=O)OC2CC(=O)C)C","Ingredient_weight": "444.6 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "14640","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "11351274","DrugBank_id": "NA"}

   

2-[13-(2h-1,3-benzodioxol-5-yl)tridecanoyl]-3,6-dihydroxycyclohex-2-en-1-one

2-[13-(2h-1,3-benzodioxol-5-yl)tridecanoyl]-3,6-dihydroxycyclohex-2-en-1-one

C26H36O6 (444.2512)


   

(1r,2r,3as,3br,5ar,7s,9as,9bs,11ar)-3a,7-dihydroxy-9a,11a-dimethyl-1-(6-oxopyran-3-yl)-tetradecahydrocyclopenta[a]phenanthren-2-yl acetate

(1r,2r,3as,3br,5ar,7s,9as,9bs,11ar)-3a,7-dihydroxy-9a,11a-dimethyl-1-(6-oxopyran-3-yl)-tetradecahydrocyclopenta[a]phenanthren-2-yl acetate

C26H36O6 (444.2512)


   

(6s)-2-[13-(2h-1,3-benzodioxol-5-yl)tridecanoyl]-3,6-dihydroxycyclohex-2-en-1-one

(6s)-2-[13-(2h-1,3-benzodioxol-5-yl)tridecanoyl]-3,6-dihydroxycyclohex-2-en-1-one

C26H36O6 (444.2512)


   

7-{[(1s,2s,6s)-2-(3-hydroxypropyl)-1,6-dimethyl-3-(propan-2-ylidene)cyclohexyl]methoxy}-6,8-dimethoxychromen-2-one

7-{[(1s,2s,6s)-2-(3-hydroxypropyl)-1,6-dimethyl-3-(propan-2-ylidene)cyclohexyl]methoxy}-6,8-dimethoxychromen-2-one

C26H36O6 (444.2512)


   

1-[(1r,2r,4as,6s,7r,8as,12'r)-6,7,7'-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-2h-3',11'-dioxaspiro[naphthalene-1,4'-tricyclo[7.3.0.0²,⁶]dodecane]-1',6',8'-trien-12'-yl]propan-2-one

1-[(1r,2r,4as,6s,7r,8as,12'r)-6,7,7'-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-2h-3',11'-dioxaspiro[naphthalene-1,4'-tricyclo[7.3.0.0²,⁶]dodecane]-1',6',8'-trien-12'-yl]propan-2-one

C26H36O6 (444.2512)


   

(8ar)-5-methyl-3-[(14-methylpentadecyl)oxy]-1h,8h,8ah-3λ⁵-furo[3,4-e][1,3,2]dioxaphosphepine-3,6-dione

(8ar)-5-methyl-3-[(14-methylpentadecyl)oxy]-1h,8h,8ah-3λ⁵-furo[3,4-e][1,3,2]dioxaphosphepine-3,6-dione

C23H41O6P (444.2641)


   

7-{[2-(3-hydroxypropyl)-1,6-dimethyl-3-(propan-2-ylidene)cyclohexyl]methoxy}-6,8-dimethoxychromen-2-one

7-{[2-(3-hydroxypropyl)-1,6-dimethyl-3-(propan-2-ylidene)cyclohexyl]methoxy}-6,8-dimethoxychromen-2-one

C26H36O6 (444.2512)


   

12-(2,4-dimethyloxolan-2-yl)-4,7,15,18-tetramethyl-3,5,14,16-tetraoxapentacyclo[11.7.0.0²,¹⁰.0⁴,⁸.0¹⁵,¹⁹]icosa-1(13),2(10),11-trien-11-ol

12-(2,4-dimethyloxolan-2-yl)-4,7,15,18-tetramethyl-3,5,14,16-tetraoxapentacyclo[11.7.0.0²,¹⁰.0⁴,⁸.0¹⁵,¹⁹]icosa-1(13),2(10),11-trien-11-ol

C26H36O6 (444.2512)


   

(2e,4e)-5-[(1s,2r,6s,7s,9s,10s,11s,12s,17r)-10,11-dihydroxy-2,6,15,19-tetramethyl-3,8-dioxatetracyclo[9.8.0.0²,⁷.0¹²,¹⁷]nonadeca-14,18-dien-9-yl]penta-2,4-dienoic acid

(2e,4e)-5-[(1s,2r,6s,7s,9s,10s,11s,12s,17r)-10,11-dihydroxy-2,6,15,19-tetramethyl-3,8-dioxatetracyclo[9.8.0.0²,⁷.0¹²,¹⁷]nonadeca-14,18-dien-9-yl]penta-2,4-dienoic acid

C26H36O6 (444.2512)


   

1-[(1r,2r,4as,6s,7r,8as,12's)-6,7,7'-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-2h-3',11'-dioxaspiro[naphthalene-1,4'-tricyclo[7.3.0.0²,⁶]dodecane]-1',6',8'-trien-12'-yl]propan-2-one

1-[(1r,2r,4as,6s,7r,8as,12's)-6,7,7'-trihydroxy-2,5,5,8a-tetramethyl-3,4,4a,6,7,8-hexahydro-2h-3',11'-dioxaspiro[naphthalene-1,4'-tricyclo[7.3.0.0²,⁶]dodecane]-1',6',8'-trien-12'-yl]propan-2-one

C26H36O6 (444.2512)


   

methyl 5,5,8a-trimethyl-4-[(2-methylbut-2-enoyl)oxy]-1-[2-(2-oxo-5h-furan-3-yl)ethyl]-1,4,4a,6,7,8-hexahydronaphthalene-2-carboxylate

methyl 5,5,8a-trimethyl-4-[(2-methylbut-2-enoyl)oxy]-1-[2-(2-oxo-5h-furan-3-yl)ethyl]-1,4,4a,6,7,8-hexahydronaphthalene-2-carboxylate

C26H36O6 (444.2512)


   

(1s,2s)-2-hydroxy-1-(7-methoxy-2-oxochromen-8-yl)-3-methylbut-3-en-1-yl (2r)-2-methyldecanoate

(1s,2s)-2-hydroxy-1-(7-methoxy-2-oxochromen-8-yl)-3-methylbut-3-en-1-yl (2r)-2-methyldecanoate

C26H36O6 (444.2512)


   

(4e)-13-{5-[(9e)-11-hydroxytridec-9-en-1,12-diyn-1-yl]furan-2-yl}tridec-4-en-1,12-diyn-3-ol

(4e)-13-{5-[(9e)-11-hydroxytridec-9-en-1,12-diyn-1-yl]furan-2-yl}tridec-4-en-1,12-diyn-3-ol

C30H36O3 (444.2664)


   

(2e,4e,6e,8e,10e,12z,14z,16e)-17-(4-hydroxy-2,6,6-trimethyl-3-oxocyclohexa-1,4-dien-1-yl)-2,6,11,15-tetramethylheptadeca-2,4,6,8,10,12,14,16-octaenal

(2e,4e,6e,8e,10e,12z,14z,16e)-17-(4-hydroxy-2,6,6-trimethyl-3-oxocyclohexa-1,4-dien-1-yl)-2,6,11,15-tetramethylheptadeca-2,4,6,8,10,12,14,16-octaenal

C30H36O3 (444.2664)


   

(2r,3e)-5-(3-formyl-2,6-dihydroxy-4-methylphenyl)-3-methyl-1-[(1s,2r,6r)-1,2,6-trimethyl-3-oxocyclohexyl]pent-3-en-2-yl propanoate

(2r,3e)-5-(3-formyl-2,6-dihydroxy-4-methylphenyl)-3-methyl-1-[(1s,2r,6r)-1,2,6-trimethyl-3-oxocyclohexyl]pent-3-en-2-yl propanoate

C26H36O6 (444.2512)


   

(3r,8as)-5-butyl-3-(tridecyloxy)-1h,8h,8ah-3λ⁵-furo[3,4-e][1,3,2]dioxaphosphepine-3,6-dione

(3r,8as)-5-butyl-3-(tridecyloxy)-1h,8h,8ah-3λ⁵-furo[3,4-e][1,3,2]dioxaphosphepine-3,6-dione

C23H41O6P (444.2641)


   

(4s,4as,5s,8ar,9r)-8a-hydroxy-3,4a,5-trimethyl-9-{[(2e)-2-methylbut-2-enoyl]oxy}-4h,5h,6h,7h,8h,9h-naphtho[2,3-b]furan-4-yl (2e)-3-methylpent-2-enoate

(4s,4as,5s,8ar,9r)-8a-hydroxy-3,4a,5-trimethyl-9-{[(2e)-2-methylbut-2-enoyl]oxy}-4h,5h,6h,7h,8h,9h-naphtho[2,3-b]furan-4-yl (2e)-3-methylpent-2-enoate

C26H36O6 (444.2512)


   

(1e)-2-[(1s,5s,7r,8s,11r)-11-(2-methoxypropan-2-yl)-8-methyl-3-oxo-5-(2-oxopropyl)-4-oxatricyclo[6.3.1.0²,⁶]dodec-2(6)-en-7-yl]ethenyl 3-methylbut-2-enoate

(1e)-2-[(1s,5s,7r,8s,11r)-11-(2-methoxypropan-2-yl)-8-methyl-3-oxo-5-(2-oxopropyl)-4-oxatricyclo[6.3.1.0²,⁶]dodec-2(6)-en-7-yl]ethenyl 3-methylbut-2-enoate

C26H36O6 (444.2512)


   

5-methyl-3-[(14-methylpentadecyl)oxy]-1h,8h,8ah-3λ⁵-furo[3,4-e][1,3,2]dioxaphosphepine-3,6-dione

5-methyl-3-[(14-methylpentadecyl)oxy]-1h,8h,8ah-3λ⁵-furo[3,4-e][1,3,2]dioxaphosphepine-3,6-dione

C23H41O6P (444.2641)


   

(1s,7s,8z,12s,13s,14s)-14-(acetyloxy)-4,9,13,17-tetramethyl-5-oxo-6-oxatricyclo[11.4.0.0³,⁷]heptadeca-3,8,16-trien-12-yl butanoate

(1s,7s,8z,12s,13s,14s)-14-(acetyloxy)-4,9,13,17-tetramethyl-5-oxo-6-oxatricyclo[11.4.0.0³,⁷]heptadeca-3,8,16-trien-12-yl butanoate

C26H36O6 (444.2512)


   

(3r,8as)-5-(2-methylpropyl)-3-(tridecyloxy)-1h,8h,8ah-3λ⁵-furo[3,4-e][1,3,2]dioxaphosphepine-3,6-dione

(3r,8as)-5-(2-methylpropyl)-3-(tridecyloxy)-1h,8h,8ah-3λ⁵-furo[3,4-e][1,3,2]dioxaphosphepine-3,6-dione

C23H41O6P (444.2641)


   

(3r,8ar)-5-methyl-3-[(14-methylpentadecyl)oxy]-1h,8h,8ah-3λ⁵-furo[3,4-e][1,3,2]dioxaphosphepine-3,6-dione

(3r,8ar)-5-methyl-3-[(14-methylpentadecyl)oxy]-1h,8h,8ah-3λ⁵-furo[3,4-e][1,3,2]dioxaphosphepine-3,6-dione

C23H41O6P (444.2641)


   

(4r,7r,8r,15r,18r,19r)-12-[(2r,4r)-2,4-dimethyloxolan-2-yl]-4,7,15,18-tetramethyl-3,5,14,16-tetraoxapentacyclo[11.7.0.0²,¹⁰.0⁴,⁸.0¹⁵,¹⁹]icosa-1(13),2(10),11-trien-11-ol

(4r,7r,8r,15r,18r,19r)-12-[(2r,4r)-2,4-dimethyloxolan-2-yl]-4,7,15,18-tetramethyl-3,5,14,16-tetraoxapentacyclo[11.7.0.0²,¹⁰.0⁴,⁸.0¹⁵,¹⁹]icosa-1(13),2(10),11-trien-11-ol

C26H36O6 (444.2512)


   

3,4a,5-trimethyl-2-{3,5,9-trimethyl-6h,7h,8h,9h-naphtho[1,2-b]furan-2-yl}-4h,5h,6h,7h,9h-naphtho[2,3-b]furan-4-ol

3,4a,5-trimethyl-2-{3,5,9-trimethyl-6h,7h,8h,9h-naphtho[1,2-b]furan-2-yl}-4h,5h,6h,7h,9h-naphtho[2,3-b]furan-4-ol

C30H36O3 (444.2664)


   

(3r,8as)-5-ethyl-3-(pentadecyloxy)-1h,8h,8ah-3λ⁵-furo[3,4-e][1,3,2]dioxaphosphepine-3,6-dione

(3r,8as)-5-ethyl-3-(pentadecyloxy)-1h,8h,8ah-3λ⁵-furo[3,4-e][1,3,2]dioxaphosphepine-3,6-dione

C23H41O6P (444.2641)


   

(5r)-4-hydroxy-5-[(2z,6s,7e,9e)-13-(5-methoxy-2-oxo-5h-furan-3-yl)-2,6,10-trimethyltrideca-2,7,9-trien-1-yl]-3-methyl-5h-furan-2-one

(5r)-4-hydroxy-5-[(2z,6s,7e,9e)-13-(5-methoxy-2-oxo-5h-furan-3-yl)-2,6,10-trimethyltrideca-2,7,9-trien-1-yl]-3-methyl-5h-furan-2-one

C26H36O6 (444.2512)


   

methyl (1r,4s,4as,8ar)-5,5,8a-trimethyl-4-{[(2z)-2-methylbut-2-enoyl]oxy}-1-[2-(2-oxo-5h-furan-3-yl)ethyl]-1,4,4a,6,7,8-hexahydronaphthalene-2-carboxylate

methyl (1r,4s,4as,8ar)-5,5,8a-trimethyl-4-{[(2z)-2-methylbut-2-enoyl]oxy}-1-[2-(2-oxo-5h-furan-3-yl)ethyl]-1,4,4a,6,7,8-hexahydronaphthalene-2-carboxylate

C26H36O6 (444.2512)


   

8,16-diisopropyl-5,11,19-trimethyl-13-oxapentacyclo[12.8.0.0³,¹².0⁴,⁹.0¹⁷,²²]docosa-3(12),4,6,8,10,17(22),18,20-octaene-1,20-diol

8,16-diisopropyl-5,11,19-trimethyl-13-oxapentacyclo[12.8.0.0³,¹².0⁴,⁹.0¹⁷,²²]docosa-3(12),4,6,8,10,17(22),18,20-octaene-1,20-diol

C30H36O3 (444.2664)


   

(2z,6e)-10-[(3e,4s,5r)-4-(acetyloxy)-5-(2-methylprop-1-en-1-yl)-2-oxooxolan-3-ylidene]-3,7-dimethyldeca-2,6-dien-1-yl 2-methylprop-2-enoate

(2z,6e)-10-[(3e,4s,5r)-4-(acetyloxy)-5-(2-methylprop-1-en-1-yl)-2-oxooxolan-3-ylidene]-3,7-dimethyldeca-2,6-dien-1-yl 2-methylprop-2-enoate

C26H36O6 (444.2512)


   

5-(3-formyl-2,6-dihydroxy-4-methylphenyl)-3-methyl-1-(1,2,6-trimethyl-3-oxocyclohexyl)pent-3-en-2-yl propanoate

5-(3-formyl-2,6-dihydroxy-4-methylphenyl)-3-methyl-1-(1,2,6-trimethyl-3-oxocyclohexyl)pent-3-en-2-yl propanoate

C26H36O6 (444.2512)


   

(2r,2's,4'ar,4'bs,7's,8'ar,10'ar)-2',4,5,7'-tetrahydroxy-4'b,8',8',10'a-tetramethyl-2',3',4',4'a,5',6',7',8'a,9',10'-decahydro-3h-spiro[1-benzofuran-2,1'-phenanthrene]-7-carbaldehyde

(2r,2's,4'ar,4'bs,7's,8'ar,10'ar)-2',4,5,7'-tetrahydroxy-4'b,8',8',10'a-tetramethyl-2',3',4',4'a,5',6',7',8'a,9',10'-decahydro-3h-spiro[1-benzofuran-2,1'-phenanthrene]-7-carbaldehyde

C26H36O6 (444.2512)


   

(1r,14r,16s)-8,16-diisopropyl-5,11,19-trimethyl-13-oxapentacyclo[12.8.0.0³,¹².0⁴,⁹.0¹⁷,²²]docosa-3(12),4,6,8,10,17(22),18,20-octaene-1,20-diol

(1r,14r,16s)-8,16-diisopropyl-5,11,19-trimethyl-13-oxapentacyclo[12.8.0.0³,¹².0⁴,⁹.0¹⁷,²²]docosa-3(12),4,6,8,10,17(22),18,20-octaene-1,20-diol

C30H36O3 (444.2664)


   

(1r,3'as,3'br,5'ar,6's,9'as,9'bs,11'as)-9'a-(hydroxymethyl)-3'b,6',11'a-trimethyl-2,5-dioxo-3'a,4',5',5'a,7',8',9',9'b,10',11'-decahydro-3'h-spiro[cyclohexane-1,2'-phenanthro[2,1-b]fura]-3-ene-6'-carboxylic acid

(1r,3'as,3'br,5'ar,6's,9'as,9'bs,11'as)-9'a-(hydroxymethyl)-3'b,6',11'a-trimethyl-2,5-dioxo-3'a,4',5',5'a,7',8',9',9'b,10',11'-decahydro-3'h-spiro[cyclohexane-1,2'-phenanthro[2,1-b]fura]-3-ene-6'-carboxylic acid

C26H36O6 (444.2512)


   

(1s,3r,3as,4s,9ar)-1-(acetyloxy)-3-hydroxy-3-isopropyl-7,9a-dimethyl-1h,2h,3ah,4h,5h,6h,9h-cyclopenta[8]annulen-4-yl 4-methoxybenzoate

(1s,3r,3as,4s,9ar)-1-(acetyloxy)-3-hydroxy-3-isopropyl-7,9a-dimethyl-1h,2h,3ah,4h,5h,6h,9h-cyclopenta[8]annulen-4-yl 4-methoxybenzoate

C26H36O6 (444.2512)


   

(8ar)-3-(hexadecyloxy)-5-methyl-1h,8h,8ah-3λ⁵-furo[3,4-e][1,3,2]dioxaphosphepine-3,6-dione

(8ar)-3-(hexadecyloxy)-5-methyl-1h,8h,8ah-3λ⁵-furo[3,4-e][1,3,2]dioxaphosphepine-3,6-dione

C23H41O6P (444.2641)


   

methyl (3ar,3bs,5ar,7s,9as,9br,11ar)-9a-formyl-1,7-dihydroxy-2,3b,6,6,11,11a-hexamethyl-3-oxo-4h,5h,5ah,7h,8h,9h,9bh-cyclopenta[a]phenanthrene-3a-carboxylate

methyl (3ar,3bs,5ar,7s,9as,9br,11ar)-9a-formyl-1,7-dihydroxy-2,3b,6,6,11,11a-hexamethyl-3-oxo-4h,5h,5ah,7h,8h,9h,9bh-cyclopenta[a]phenanthrene-3a-carboxylate

C26H36O6 (444.2512)


   

(1s,3'as,3'br,5'ar,6's,9'as,9'bs,11'as)-9'a-(hydroxymethyl)-3'b,6',11'a-trimethyl-2,5-dioxo-3'a,4',5',5'a,7',8',9',9'b,10',11'-decahydro-3'h-spiro[cyclohexane-1,2'-phenanthro[2,1-b]fura]-3-ene-6'-carboxylic acid

(1s,3'as,3'br,5'ar,6's,9'as,9'bs,11'as)-9'a-(hydroxymethyl)-3'b,6',11'a-trimethyl-2,5-dioxo-3'a,4',5',5'a,7',8',9',9'b,10',11'-decahydro-3'h-spiro[cyclohexane-1,2'-phenanthro[2,1-b]fura]-3-ene-6'-carboxylic acid

C26H36O6 (444.2512)


   

methyl (1r,2s,5s,10s,11s,13r,15s)-15-hydroxy-2,6,6,10,13,15-hexamethyl-17-methylidene-7,14,16-trioxotetracyclo[11.3.1.0²,¹¹.0⁵,¹⁰]heptadecane-1-carboxylate

methyl (1r,2s,5s,10s,11s,13r,15s)-15-hydroxy-2,6,6,10,13,15-hexamethyl-17-methylidene-7,14,16-trioxotetracyclo[11.3.1.0²,¹¹.0⁵,¹⁰]heptadecane-1-carboxylate

C26H36O6 (444.2512)


   

methyl (2r,10r,14r)-14-acetyl-14-hydroxy-2,6,6,10,13-pentamethyl-16-methylidene-7,15-dioxotetracyclo[11.2.1.0²,¹¹.0⁵,¹⁰]hexadecane-1-carboxylate

methyl (2r,10r,14r)-14-acetyl-14-hydroxy-2,6,6,10,13-pentamethyl-16-methylidene-7,15-dioxotetracyclo[11.2.1.0²,¹¹.0⁵,¹⁰]hexadecane-1-carboxylate

C26H36O6 (444.2512)


   

(1r,5r,10r,13r,14s,16s,19s,21r,23r,24r)-7-isopropyl-19-methoxy-10,13-dimethyl-15,17,20,22-tetraoxaheptacyclo[12.10.0.0²,²¹.0⁵,¹³.0⁶,¹⁰.0¹⁶,²⁴.0¹⁹,²³]tetracosa-2,6-dien-24-ol

(1r,5r,10r,13r,14s,16s,19s,21r,23r,24r)-7-isopropyl-19-methoxy-10,13-dimethyl-15,17,20,22-tetraoxaheptacyclo[12.10.0.0²,²¹.0⁵,¹³.0⁶,¹⁰.0¹⁶,²⁴.0¹⁹,²³]tetracosa-2,6-dien-24-ol

C26H36O6 (444.2512)


   

14-(acetyloxy)-4,9,13,17-tetramethyl-5-oxo-6-oxatricyclo[11.4.0.0³,⁷]heptadeca-3,8,16-trien-12-yl butanoate

14-(acetyloxy)-4,9,13,17-tetramethyl-5-oxo-6-oxatricyclo[11.4.0.0³,⁷]heptadeca-3,8,16-trien-12-yl butanoate

C26H36O6 (444.2512)


   

7-{[(1r,2r,6r)-2-(3-hydroxypropyl)-1,6-dimethyl-3-(propan-2-ylidene)cyclohexyl]methoxy}-6,8-dimethoxychromen-2-one

7-{[(1r,2r,6r)-2-(3-hydroxypropyl)-1,6-dimethyl-3-(propan-2-ylidene)cyclohexyl]methoxy}-6,8-dimethoxychromen-2-one

C26H36O6 (444.2512)


   

(1e)-2-[(1s,5s,7r,8s,11s)-11-(2-methoxypropan-2-yl)-8-methyl-3-oxo-5-(2-oxopropyl)-4-oxatricyclo[6.3.1.0²,⁶]dodec-2(6)-en-7-yl]ethenyl 3-methylbut-2-enoate

(1e)-2-[(1s,5s,7r,8s,11s)-11-(2-methoxypropan-2-yl)-8-methyl-3-oxo-5-(2-oxopropyl)-4-oxatricyclo[6.3.1.0²,⁶]dodec-2(6)-en-7-yl]ethenyl 3-methylbut-2-enoate

C26H36O6 (444.2512)