Exact Mass: 554.202922

Exact Mass Matches: 554.202922

Found 418 metabolites which its exact mass value is equals to given mass value 554.202922, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Bis(N-pantothenylamidoethyl) disulfide

2,4-Dihydroxy-N-{2-[(2-{[2-({1-hydroxy-3-[(1,2,4-trihydroxy-3,3-dimethylbutylidene)amino]propylidene}amino)ethyl]disulphanyl}ethyl)-C-hydroxycarbonimidoyl]ethyl}-3,3-dimethylbutanimidic acid

C22H42N4O8S2 (554.2443932)

Same as: D01234 Pantethine (D-Pantethine) is the dimer form of pantothenic acid, an intermediate in the production of coenzyme A, and can be used as a dietary supplement to study acne and improve blood cholesterol.

Toonacilin

C31H38O9 (554.2515698)

Osthenol-7-O-beta-D-gentiobioside

C26H34O13 (554.1999314)

lappaol C

4-[[3-[1,3-Dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]-4-hydroxy-5-methoxyphenyl]methyl]-3-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one

C30H34O10 (554.2151864)

R207910

1-(6-Bromo-2-methoxy-quinolin-3-yl)-4-dimethylamino-2-naphthalen-1-yl-1-phenyl-butan-2-ol

C32H31BrN2O2 (554.1568766)

D-Pantethine

(2R)-N-[2-({2-[(2-{3-[(2R)-2,4-dihydroxy-3,3-dimethylbutanamido]propanamido}ethyl)disulfanyl]ethyl}carbamoyl)ethyl]-2,4-dihydroxy-3,3-dimethylbutanamide

C22H42N4O8S2 (554.2443932)

D-Pantethine, also known as pantetina or pantomin, belongs to the class of organic compounds known as beta amino acids and derivatives. These are amino acids having a (-NH2) group attached to the beta carbon atom. Most vitamin B5 supplements are in the form of calcium pantothenate, a salt of pantothenic acid, with doses in the range of 5 to 10 mg/day. Pantethine is available in the United States as a dietary supplement because of evidence of its health benefits for lowering elevated LDL-cholesterol and triglycerides, and raising HDL-cholesterol (the good cholesterol). In contrast, pantethine is sold as a dietary supplement for lowering blood cholesterol and triglycerides at doses of 500 to 1200 mg/day. These clinical trials were conducted with daily intakes ranging from 600 to 1200 mg/day. Pantethine (bis-pantethine or co-enzyme pantethine) is a dimeric form of pantetheine, which is produced from pantothenic acid (vitamin B5) by the addition of cysteamine. D-Pantethine is a drug. Pantetheine is an intermediate in the production of coenzyme A by the body. In multiple clinical trials of patients with elevated cholesterol and triglycerides, total and LDL cholesterol were decreased by an average of 12\\\%, triglycerides decreased by 19\\\%, and HDL cholesterol was increased by 9\\\%. Pantethine is composed of two molecules of pantetheine linked by a bridging disulfide. Most of the literature on pantethine and lipids is 20 to 30 years old, but recent carefully controlled trials of 600 and 900 mg/d doses have shown similar statistically significant lowering of LDL cholesterol in individuals with greatly or moderately elevated levels of blood lipids. A few trials conducted in Japan tested 300 mg/day and reported decreases in total cholesterol of about 4\\\%, increases in HDL-cholesterol of 5\\\% and inconsistent results for triglycerides. Direct dose-response evidence is not available because no trial tested more than one dose. Within this dose range there is no evidence of a dose-effect relationship, i.e. changes in lipid concentrations overlapped across the range of doses. Pantethine (Bis-pantethine) or "Co-enzyme pantethine" is a dimeric form of vitamin B5, composed of two molecules of pantothenic acid linked by cysteamine bridging groups. The monomer of this compound is known as pantetheine and is an intermediate in the production of Coenzyme A by the body. Pantethine is considered the more biologically active form of vitamin B5, but is less stable than pantothenic acid and tends to decompose over time if it is not kept refrigerated, so most vitamin B5 supplements are in the form of calcium pantothenate. [HMDB] A - Alimentary tract and metabolism > A11 - Vitamins Same as: D01234 Pantethine (D-Pantethine) is the dimer form of pantothenic acid, an intermediate in the production of coenzyme A, and can be used as a dietary supplement to study acne and improve blood cholesterol.

Ssioriside

2-{4-hydroxy-2,3-bis[(4-hydroxy-3,5-dimethoxyphenyl)methyl]butoxy}oxane-3,4,5-triol

C27H38O12 (554.2363148)

Ssioriside is found in fruits. Ssioriside is isolated from Prunus padus (bird cherry). Isolated from Prunus padus (bird cherry). Ssioriside is found in fruits.

Marmesin rutinoside

2-{2-[(3,4,5-trihydroxy-6-{[(3,4,5-trihydroxy-6-methyloxan-2-yl)oxy]methyl}oxan-2-yl)oxy]propan-2-yl}-2H,3H,7H-furo[3,2-g]chromen-7-one

C26H34O13 (554.1999314)

Marmesin rutinoside is found in herbs and spices. Marmesin rutinoside is a constituent of the roots of Murraya koenigii (curry leaf tree). Constituent of the roots of Murraya koenigii (curry leaf tree). Marmesin rutinoside is found in herbs and spices.

23-Hydroxyphysalolactone

6-(1-{8-chloro-6,7,11,14-tetrahydroxy-2,15-dimethyl-3-oxotetracyclo[8.7.0.0²,⁷.0¹¹,¹⁵]heptadec-4-en-14-yl}-1-hydroxyethyl)-5-hydroxy-3,4-dimethyl-5,6-dihydro-2H-pyran-2-one

C28H39ClO9 (554.2282474)

23-Hydroxyphysalolactone is found in fruits. 23-Hydroxyphysalolactone is a constituent of Physalis peruviana (Cape gooseberry) Constituent of Physalis peruviana (Cape gooseberry). 23-Hydroxyphysalolactone is found in fruits.

Lippioside II

1-{[6-({[(2E)-3-(3,4-dihydroxyphenyl)prop-2-enoyl]oxy}methyl)-3,4,5-trihydroxyoxan-2-yl]oxy}-6,7-dihydroxy-7-methyl-1H,4aH,5H,6H,7H,7aH-cyclopenta[c]pyran-4-carboxylic acid

C25H30O14 (554.163548)

Lippioside II is found in herbs and spices. Lippioside II is a constituent of Lippia graveolens (Mexican oregano)

Lappaol C

4-({3-[1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]-4-hydroxy-5-methoxyphenyl}methyl)-3-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one

C30H34O10 (554.2151864)

Lappaol c is a member of the class of compounds known as dibenzylbutyrolactone lignans. Dibenzylbutyrolactone lignans are lignan compounds containing a 3,4-dibenzyloxolan-2-one moiety. Lappaol c is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Lappaol c can be found in burdock, which makes lappaol c a potential biomarker for the consumption of this food product.

Isolappaol C

(4R)-4-({3-[1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]-4-hydroxy-5-methoxyphenyl}methyl)-5-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-3-one

C30H34O10 (554.2151864)

Isolappaol c is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Isolappaol c can be found in burdock, which makes isolappaol c a potential biomarker for the consumption of this food product.

Arctignan A

(3R,4R)-3-[[4-[1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]oxy-3-methoxyphenyl]methyl]-4-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one

C30H34O10 (554.2151864)

Arctignan a is a member of the class of compounds known as dibenzylbutyrolactone lignans. Dibenzylbutyrolactone lignans are lignan compounds containing a 3,4-dibenzyloxolan-2-one moiety. Arctignan a is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Arctignan a can be found in burdock, which makes arctignan a a potential biomarker for the consumption of this food product.

Lappaol E

4-[(4-{[1,3-dihydroxy-1-(4-hydroxy-3-methoxyphenyl)propan-2-yl]oxy}-3-methoxyphenyl)methyl]-3-[(4-hydroxy-3-methoxyphenyl)methyl]oxolan-2-one

C30H34O10 (554.2151864)

Lappaol e is a member of the class of compounds known as dibenzylbutyrolactone lignans. Dibenzylbutyrolactone lignans are lignan compounds containing a 3,4-dibenzyloxolan-2-one moiety. Lappaol e is practically insoluble (in water) and a very weakly acidic compound (based on its pKa). Lappaol e can be found in burdock, which makes lappaol e a potential biomarker for the consumption of this food product.

7-O-Methylaloeresin A

[(2S,3R,4S,5S,6R)-4,5-dihydroxy-6-(hydroxymethyl)-2-[7-methoxy-5-methyl-4-oxo-2-(2-oxopropyl)chromen-8-yl]oxan-3-yl] (E)-3-(4-hydroxyphenyl)prop-2-enoate

C29H30O11 (554.178803)

7-O-Methylaloeresin A is a natural product found in Aloe africana, Aloe perryi, and Aloe marlothii with data available.

7-Isovaleroylcycloseverinolide

C31H38O9 (554.2515698)

Eriosemaside A

C26H34O13 (554.1999314)

3,12-Diacetyl-8-benzoylingol

(-)-3,12-Diacetyl-8-benzoylingol

C31H38O9 (554.2515698)

Vestitol-(5-

3)-7,2-dihydroxy-4-methoxyflavone

C32H26O9 (554.1576746000001)

Citrumarin A

C34H34O7 (554.2304414)

Seguinoside E

C25H30O14 (554.163548)

Intrapetacin B

C31H38O9 (554.2515698)

Milolide I

C27H38O12 (554.2363148)

Cerberalignan D

C30H34O10 (554.2151864)

Taxuspine Y

C31H38O9 (554.2515698)

Isolappaol C

C30H34O10 (554.2151864)

(-)-Massoniresinol 4-O-beta-D-glucopyranoside

C26H34O13 (554.1999314)

Physalin V

C30H34O10 (554.2151864)

Myobontioside B

C25H30O14 (554.163548)

SCHEMBL15172324

C27H38O12 (554.2363148)

TMC 2C

C28H34N4O8 (554.2376524)

Erythrolide D

C26H31ClO11 (554.1554806)

Erythrolide F

C26H31ClO11 (554.1554806)

8-C-Glucosylchromone 2-O-p-methoxycoumaroyl 5-methyl-7-hydroxy 2-acetonyl

C29H30O11 (554.178803)

Casearborin D

C31H38O9 (554.2515698)

Bidebiline B

C35H26N2O5 (554.1841626)

Deacetylhirtin

C30H34O10 (554.2151864)

N-methylheteropsine

C36H30N2O4 (554.220546)

threo-Carolignan K

C30H34O10 (554.2151864)

Rubriflorin C

C31H38O9 (554.2515698)

arillanin G

C25H30O14 (554.163548)

Swietmanin G

C31H38O9 (554.2515698)

Ligustrosidic acid

(2E)-2-[4-[2-[2-(4-hydroxyphenyl)ethoxy]-2-oxoethyl]-5-methoxycarbonyl-2-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4H-pyran-3-ylidene]acetic acid

C25H30O14 (554.163548)

Ligustrosidic acid is a natural product found in Ligustrum lucidum and Ligustrum japonicum with data available. Ligustrosidic acid is a natural compound isolated from ligustrum japonicum and ligustrum lucidum[1]. Ligustrosidic acid is a natural compound isolated from ligustrum japonicum and ligustrum lucidum[1].

4-Methyloleuropein

C26H34O13 (554.1999314)

23-Hydroxyphysalolactone

6-(1-{8-chloro-6,7,11,14-tetrahydroxy-2,15-dimethyl-3-oxotetracyclo[8.7.0.0^{2,7}.0^{11,15}]heptadec-4-en-14-yl}-1-hydroxyethyl)-5-hydroxy-3,4-dimethyl-5,6-dihydro-2H-pyran-2-one

C28H39ClO9 (554.2282474)

methyl (4aS,5R,7S,7aS)-7-hydroxy-5-[3-(4-hydroxyphenyl)propanoyloxy]-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-carboxylate

methyl (4aS,5R,7S,7aS)-7-hydroxy-5-[3-(4-hydroxyphenyl)propanoyloxy]-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-carboxylate

C26H34O13 (554.1999314)

Bedaquiline (Mixture of DiastereoMers)

C32H31BrN2O2 (554.1568766)

icariside E6

C27H38O12 (554.2363148)

MS000042291

C25H30O14 (554.163548)

Guajacylglycerin-beta-pinoresinol-aether|Guajacylglycerin-epipinoresinol-aether

C30H34O10 (554.2151864)

Cerberalignan E

C30H34O10 (554.2151864)

SCHEMBL18812221

C29H30O11 (554.178803)

7-O-[beta-D-glucopyranosyl-(1->2)-beta-D-glucopyranosyl]demethylsuberosin

C26H34O13 (554.1999314)

chloramultiol B

C30H34O10 (554.2151864)

alangicadinoside C

C27H38O12 (554.2363148)

3-hydroxy-5,6-epoxy-beta-ionone 3-O-tetra-O-acetyl-beta-D-glucopyranoside

C27H38O12 (554.2363148)

p-Hydroxybenzoylvernovan

C29H30O11 (554.178803)

Vestitol-(5->2)-2-hydroxyformononetin

C32H26O9 (554.1576746000001)

aglaiformosanin

C32H30N2O7 (554.205291)

splenocin F

C29H34N2O9 (554.2264194)

grasshopper ketone 3-O-tetra-O-acetyl-beta-D-glucopyranoside

C27H38O12 (554.2363148)

splenocin C

C29H34N2O9 (554.2264194)

Macranthoside

C26H34O13 (554.1999314)

flacoside A

C26H34O13 (554.1999314)

2-(E)-cinnamoylsalicortin|2-Cinnamoylsalicortin

C29H30O11 (554.178803)

6-O-[(6-O-allophanyl)-beta-D-glucopyranosyl]-5-methoxy-7-phenyl-3H-benzo[de]isochromen-1-one

C27H26N2O11 (554.1536526)

22.22-Dimethyl-italipyron-triacetat

C30H34O10 (554.2151864)

(2S)-2-<2-(6-methoxy)-naphthyl>propyonyl 2-O-beta-D-glucopyranosyl-beta-D-glucopyranoside

C26H34O13 (554.1999314)

Lappaol E

C30H34O10 (554.2151864)

tetraacetylroseoside

C27H38O12 (554.2363148)

Me glycoside,3-nenzyl,tetra-Ac-beta-Pyranose-4-O-alpha-D-Xylopyranosyl-D-xylose

C26H34O13 (554.1999314)

C32H26O9

C32H26O9 (554.1576746000001)

marinoid D

C25H30O14 (554.163548)

artabotrysine

C35H26N2O5 (554.1841626)

cuscutaresinol A|cuscutaresinol B

C30H34O10 (554.2151864)

(7S,8R)-4,7,9,9-tetrahydroxy-3,3-dimethoxy-7-oxo-8-4-oxyneolignan-4-O-beta-D-glucopyranoside|arctiinoside A

C26H34O13 (554.1999314)

3beta-benzoyloxy-5alpha,7beta-diacetoxy-15beta-hydroxyjatropha-6(17),11E-diene-9,14-dione

C31H38O9 (554.2515698)

6(3,4-dimethoxycinnamoyl)harpagide

C26H34O13 (554.1999314)

1-O-methacryl-28-oxosalannic acid methyl ester|3-O-deacetyl-4-demethyl-28-oxosalannin

C31H38O9 (554.2515698)

hopeachinol D

C25H30O14 (554.163548)

Asperpyrone E

C32H26O9 (554.1576746000001)

orthosiphol D

C31H38O9 (554.2515698)

10-O-vanilloyltheviridoside

C25H30O14 (554.163548)

14,15-didehydroruageanin A

C31H38O9 (554.2515698)

aurisin G

C31H38O9 (554.2515698)

javanic acid A

C26H34O13 (554.1999314)

C31H38O9

C31H38O9 (554.2515698)

Sarcandrone A

C33H30O8 (554.194058)

Sarcandrone B

C33H30O8 (554.194058)

threo-Carolignan H

C30H34O10 (554.2151864)

Vestitol-(5->3)-7,2-dihydroxy-4-methoxyflavone

C32H26O9 (554.1576746000001)

4-(O-beta-D-glucopyranosyl)-7,9-dihydroxy-3,3,5-trimethoxy-8,4-oxy-9-norneolignan-7-one

C26H34O13 (554.1999314)

C27H38O12

C27H38O12 (554.2363148)

(1S,2R,3S,6S,7R,8R,9S,10S,11R*,13Z)-3,9-diacetoxy-6-chloro-8-hydroxy-2-propionyloxybriara-5(16),13-diene-12,18-dione|3, 9-Di-Ac, 2-propanoyl-6-Chloro-2, 3, 8, 9-tetrahydroxy-12-oxo-5(16), 13-briaradien-18, 7-olide

(1S*,2R*,3S*,6S*,7R*,8R*,9S*,10S*,11R*,13Z)-3,9-diacetoxy-6-chloro-8-hydroxy-2-propionyloxybriara-5(16),13-diene-12,18-dione|3, 9-Di-Ac, 2-propanoyl-6-Chloro-2, 3, 8, 9-tetrahydroxy-12-oxo-5(16), 13-briaradien-18, 7-olide

C27H35ClO10 (554.191864)

(-)-massoniresinol 4-O-beta-D-glucopyranoside|(-)-massoniresinol 4-O-beta-D-glucopyranoside|(-)-Massoniresinol 4-O-??-D-glucopyranoside

C26H34O13 (554.1999314)

6-methoxysorigenin-8-O-rutinoside|8,9-dihydroxy-6-methoxy-naphthalide 8-O-beta-rutinoside

C25H30O14 (554.163548)

(3aS,3bR,3cR,4aS,5R,5aR,8aS,8bS,9S,10S,10aR)-3a,3b,3c,4a,5,5a,8a,9,10,10a-decahydro-5,5a-dihydroxy-4a-(hydroxymethyl)-7,9-dimethyl-10a-(1-methylethenyl)-10-(1-oxopropoxy)-2-phenyl-6H-2,8b-epoxyoxireno[6,7]azuleno[5,4-e]-1,3-benzodioxol-6-one|yuanhuaoate A

(3aS,3bR,3cR,4aS,5R,5aR,8aS,8bS,9S,10S,10aR)-3a,3b,3c,4a,5,5a,8a,9,10,10a-decahydro-5,5a-dihydroxy-4a-(hydroxymethyl)-7,9-dimethyl-10a-(1-methylethenyl)-10-(1-oxopropoxy)-2-phenyl-6H-2,8b-epoxyoxireno[6,7]azuleno[5,4-e]-1,3-benzodioxol-6-one|yuanhuaoate A

C30H34O10 (554.2151864)

erythrolide T

C26H31ClO11 (554.1554806)

2,3-diepiingol 7,12-diacetate 8-benzoate|7,12-O-diacetyl-8-O-benxoil-2,3-diepiingol

C31H38O9 (554.2515698)

jaspofoliamoside D

C27H38O12 (554.2363148)

(-)-(7S,8R,7E)-4,7,9,3,9-pentahydroxy-3,5-dimethoxy-8-4-oxyneolign-7-ene-3-O-beta-D-glucopyranoside

C26H34O13 (554.1999314)

fragilide B

C27H35ClO10 (554.191864)

3,4-dihydro-3-oxo-actinidol-O-beta-D-tetraacetylglucopyranoside

C27H38O12 (554.2363148)

(2S,4S)-7-hydroxy-5,8-dimethoxyflavan-(4->6)-5-hydroxy-7-methoxy-flavanone|sarcandrone D

C33H30O8 (554.194058)

C26H34O13

C26H34O13 (554.1999314)

Arctignan A

C30H34O10 (554.2151864)

eleuthoside B

C25H30O14 (554.163548)

13(S*)-1beta-benzoyloxy-6alpha,7beta-diacetoxy-8beta,13-epoxy-3-neocleroden-15,16-olide|scutebata D

C31H38O9 (554.2515698)

C31H30N4O6

C31H30N4O6 (554.2165239999999)

rel-1beta-(4,6-dihydroxy-2-methoxy)benzoyl-2alpha-(2,6-dimethoxy-4-hydroxy)benzoyl-(3beta,4alpha)-diphenylcyclobutane|rel-1??-(4,6-Dihydroxy-2-methoxy)-benzoyl-rel-2??-(2,6-dimethoxy-4-hydroxy)-benzoyl-rel-(3??,4??)-diphenylcyclobutane

rel-1beta-(4,6-dihydroxy-2-methoxy)benzoyl-2alpha-(2,6-dimethoxy-4-hydroxy)benzoyl-(3beta,4alpha)-diphenylcyclobutane|rel-1??-(4,6-Dihydroxy-2-methoxy)-benzoyl-rel-2??-(2,6-dimethoxy-4-hydroxy)-benzoyl-rel-(3??,4??)-diphenylcyclobutane

C33H30O8 (554.194058)

(2S,4S)-7-hydroxy-5,8-dimethoxyflavan-(4->8)-7-hydroxy-5-methoxy-flavanone|sarcandrone C

C33H30O8 (554.194058)

C34H34O7

C34H34O7 (554.2304414)

cleistanthin D

C29H30O11 (554.178803)

A member of the class of cleistanthins that is cleistanthin A in which the 3,4-di-O-methyl-D-xylopyranosyl group is replaced by a 2,3,4-tri-O-methyl-D-xylofuranosyl group.

C25H30O14

C25H30O14 (554.163548)

8-benzyl-6-[6-(6-ethyl-7-methyl-5,8-dihydro-2-naphthalenyl)-1-oxo-3,4-dihydro-1H-isochromen-8-yl]-3,4-dihydro-1H-isochromen-1-one|salvadorin

C38H34O4 (554.2456964)

quiquelignan C

C29H30O11 (554.178803)

C33H30O8

C33H30O8 (554.194058)

C30H34O10

C30H34O10 (554.2151864)

juncin Q

C26H34O13 (554.1999314)

FT-0775608

C29H30O11 (554.178803)

3,7-O-diacetyl-5-O-benzoyl-13,17-oxy-14-oxopremyrsinol

C31H38O9 (554.2515698)

C26H34O13_Methyl (4aS,5R,7S,7aS)-1-(beta-D-glucopyranosyloxy)-7-hydroxy-5-{[3-(4-hydroxyphenyl)propanoyl]oxy}-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate

NCGC00385310-01_C26H34O13_Methyl (4aS,5R,7S,7aS)-1-(beta-D-glucopyranosyloxy)-7-hydroxy-5-{[3-(4-hydroxyphenyl)propanoyl]oxy}-7-methyl-1,4a,5,6,7,7a-hexahydrocyclopenta[c]pyran-4-carboxylate

C26H34O13 (554.1999314)

D-Pantethine

D-pantethine anhydrous

C22H42N4O8S2 (554.2443932)

Pantethine (D-Pantethine) is the dimer form of pantothenic acid, an intermediate in the production of coenzyme A, and can be used as a dietary supplement to study acne and improve blood cholesterol.

Pantethine

D-pantethine anhydrous

C22H42N4O8S2 (554.2443932)

A - Alimentary tract and metabolism > A11 - Vitamins Same as: D01234 Pantethine (D-Pantethine) is the dimer form of pantothenic acid, an intermediate in the production of coenzyme A, and can be used as a dietary supplement to study acne and improve blood cholesterol.

MMV689758

C32H31N2O2Br (554.1568765999999)

Selaginpulvilin N

C37H30O5 (554.209313)

Selariscin A

C36H26O6 (554.1729296000001)

Selariscin B

C36H26O6 (554.1729296000001)

methyl (4aS,5R,7S,7aS)-7-hydroxy-5-[3-(4-hydroxyphenyl)propanoyloxy]-7-methyl-1-[(2S,3R,4S,5S,6R)-3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxy-4a,5,6,7a-tetrahydro-1H-cyclopenta[c]pyran-4-carboxylate_major

C26H34O13 (554.1999314)

Cys Asn Arg Tyr

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-carbamoylpropanamido]-5-carbamimidamidopentanamido]-3-(4-hydroxyphenyl)propanoic acid

C22H34N8O7S (554.2271054)

Cys Asn Tyr Arg

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-carbamoylpropanamido]-3-(4-hydroxyphenyl)propanamido]-5-carbamimidamidopentanoic acid

C22H34N8O7S (554.2271054)

Cys Arg Asn Tyr

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-5-carbamimidamidopentanamido]-3-carbamoylpropanamido]-3-(4-hydroxyphenyl)propanoic acid

C22H34N8O7S (554.2271054)

Cys Arg Tyr Asn

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-5-carbamimidamidopentanamido]-3-(4-hydroxyphenyl)propanamido]-3-carbamoylpropanoic acid

C22H34N8O7S (554.2271054)

Cys Tyr Asn Arg

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-(4-hydroxyphenyl)propanamido]-3-carbamoylpropanamido]-5-carbamimidamidopentanoic acid

C22H34N8O7S (554.2271054)

Cys Tyr Arg Asn

(2S)-2-[(2S)-2-[(2S)-2-[(2R)-2-amino-3-sulfanylpropanamido]-3-(4-hydroxyphenyl)propanamido]-5-carbamimidamidopentanamido]-3-carbamoylpropanoic acid

C22H34N8O7S (554.2271054)

Asp Glu Glu Tyr

(4S)-4-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-4-carboxybutanamido]-4-{[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]carbamoyl}butanoic acid

C23H30N4O12 (554.186014)

Asp Glu Tyr Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-4-carboxybutanamido]-3-(4-hydroxyphenyl)propanamido]pentanedioic acid

C23H30N4O12 (554.186014)

Asp Phe His His

(3S)-3-amino-3-{[(1S)-1-{[(1S)-1-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}-2-(1H-imidazol-4-yl)ethyl]carbamoyl}-2-phenylethyl]carbamoyl}propanoic acid

C25H30N8O7 (554.223735)

Asp His Phe His

(3S)-3-amino-3-{[(1S)-1-{[(1S)-1-{[(1S)-1-carboxy-2-(1H-imidazol-4-yl)ethyl]carbamoyl}-2-phenylethyl]carbamoyl}-2-(1H-imidazol-4-yl)ethyl]carbamoyl}propanoic acid

C25H30N8O7 (554.223735)

Asp His His Phe

(3S)-3-amino-3-{[(1S)-1-{[(1S)-1-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}-2-(1H-imidazol-4-yl)ethyl]carbamoyl}-2-(1H-imidazol-4-yl)ethyl]carbamoyl}propanoic acid

C25H30N8O7 (554.223735)

Asp Tyr Glu Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-carboxypropanamido]-3-(4-hydroxyphenyl)propanamido]-4-carboxybutanamido]pentanedioic acid

C23H30N4O12 (554.186014)

Glu Asp Glu Tyr

(4S)-4-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]-3-carboxypropanamido]-4-{[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]carbamoyl}butanoic acid

C23H30N4O12 (554.186014)

Glu Asp Tyr Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]-3-carboxypropanamido]-3-(4-hydroxyphenyl)propanamido]pentanedioic acid

C23H30N4O12 (554.186014)

Glu Glu Asp Tyr

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

C23H30N4O12 (554.186014)

Glu Glu Phe Met

(4S)-4-[(2S)-2-amino-4-carboxybutanamido]-4-{[(1S)-1-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}-2-phenylethyl]carbamoyl}butanoic acid

C24H34N4O9S (554.2046394)

Glu Glu Met Phe

(4S)-4-[(2S)-2-amino-4-carboxybutanamido]-4-{[(1S)-1-{[(1S)-1-carboxy-2-phenylethyl]carbamoyl}-3-(methylsulfanyl)propyl]carbamoyl}butanoic acid

C24H34N4O9S (554.2046394)

Glu Glu Tyr Asp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]-4-carboxybutanamido]-3-(4-hydroxyphenyl)propanamido]butanedioic acid

C23H30N4O12 (554.186014)

Glu Phe Glu Met

(4S)-4-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]-3-phenylpropanamido]-4-{[(1S)-1-carboxy-3-(methylsulfanyl)propyl]carbamoyl}butanoic acid

C24H34N4O9S (554.2046394)

Glu Phe Met Glu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]-3-phenylpropanamido]-4-(methylsulfanyl)butanamido]pentanedioic acid

C24H34N4O9S (554.2046394)

Glu Phe Pro Tyr

(4S)-4-amino-4-{[(2S)-1-[(2S)-2-{[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]carbamoyl}pyrrolidin-1-yl]-1-oxo-3-phenylpropan-2-yl]carbamoyl}butanoic acid

C28H34N4O8 (554.2376524)

Glu Phe Tyr Pro

(2S)-1-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-carboxybutanamido]-3-phenylpropanamido]-3-(4-hydroxyphenyl)propanoyl]pyrrolidine-2-carboxylic acid

C28H34N4O8 (554.2376524)

Glu Ile Met Tyr

(4S)-4-amino-4-{[(1S,2S)-1-{[(1S)-1-{[(1S)-1-carboxy-2-(4-hydroxyphenyl)ethyl]carbamoyl}-3-(methylsulfanyl)propyl]carbamoyl}-2-methylbutyl]carbamoyl}butanoic acid