Exact Mass: 567.3559694

Exact Mass Matches: 567.3559694

Found 282 metabolites which its exact mass value is equals to given mass value 567.3559694, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Nelfinavir

(3S,4aS,8aS)-N-tert-butyl-2-[(2R,3R)-2-hydroxy-3-[(3-hydroxy-2-methylphenyl)formamido]-4-(phenylsulfanyl)butyl]-decahydroisoquinoline-3-carboxamide

C32H45N3O4S (567.3130610000001)


Nelfinavir is only found in individuals that have used or taken this drug. It is a potent HIV-1 protease inhibitor. It is used in combination with other antiviral drugs in the treatment of HIV in both adults and children. [PubChem]Nelfinavir inhibits the HIV viral proteinase enzyme which prevents cleavage of the gag-pol polyprotein, resulting in noninfectious, immature viral particles. J - Antiinfectives for systemic use > J05 - Antivirals for systemic use > J05A - Direct acting antivirals > J05AE - Protease inhibitors D000890 - Anti-Infective Agents > D000998 - Antiviral Agents > D000084762 - Viral Protease Inhibitors D000890 - Anti-Infective Agents > D000998 - Antiviral Agents > D044966 - Anti-Retroviral Agents C471 - Enzyme Inhibitor > C783 - Protease Inhibitor > C97366 - HIV Protease Inhibitor C254 - Anti-Infective Agent > C281 - Antiviral Agent > C1660 - Anti-HIV Agent D004791 - Enzyme Inhibitors > D011480 - Protease Inhibitors

   

6alpha-Glucuronosylhyodeoxycholate

6alpha-Glucuronosylhyodeoxycholate

C30H47O10 (567.3169062)


   

5-O-beta-D-Mycaminosyltylactone

5-O-β-D-Mycaminosyltylactone

C31H53NO8 (567.3770978)


A macrolide antibiotic that is tylactone having a beta-D-mycaminosyl residue attached at position 5.

   

Penitrem D

Penitrem D

C37H45NO4 (567.334841)


D009676 - Noxae > D011042 - Poisons > D009183 - Mycotoxins

   

LysoPC(22:6/0:0)

(2-{[(2R)-3-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoyloxy]-2-hydroxypropyl phosphono]oxy}ethyl)trimethylazanium

C30H50NO7P (567.332472)


LysoPC(22:6(4Z,7Z,10Z,13Z,16Z,19Z)) is a lysophospholipid (LyP). It is a monoglycerophospholipid in which a phosphorylcholine moiety occupies a glycerol substitution site. Lysophosphatidylcholines can have different combinations of fatty acids of varying lengths and saturation attached at the C-1 (sn-1) position. Fatty acids containing 16, 18 and 20 carbons are the most common. LysoPC(22:6(4Z,7Z,10Z,13Z,16Z,19Z)), in particular, consists of one chain of docosahexaenoic acid at the C-1 position. The docosahexaenoic acid moiety is derived from fish oils. Lysophosphatidylcholine is found in small amounts in most tissues. It is formed by hydrolysis of phosphatidylcholine by the enzyme phospholipase A2, as part of the de-acylation/re-acylation cycle that controls its overall molecular species composition. It can also be formed inadvertently during extraction of lipids from tissues if the phospholipase is activated by careless handling. In blood plasma significant amounts of lysophosphatidylcholine are formed by a specific enzyme system, lecithin:cholesterol acyltransferase (LCAT), which is secreted from the liver. The enzyme catalyzes the transfer of the fatty acids of position sn-2 of phosphatidylcholine to the free cholesterol in plasma, with formation of cholesterol esters and lysophosphatidylcholine. Lysophospholipids have a role in lipid signaling by acting on lysophospholipid receptors (LPL-R). LPL-Rs are members of the G protein-coupled receptor family of integral membrane proteins. [HMDB] LysoPC(22:6(4Z,7Z,10Z,13Z,16Z,19Z)) is a lysophospholipid (LyP). It is a monoglycerophospholipid in which a phosphorylcholine moiety occupies a glycerol substitution site. Lysophosphatidylcholines can have different combinations of fatty acids of varying lengths and saturation attached at the C-1 (sn-1) position. Fatty acids containing 16, 18 and 20 carbons are the most common. LysoPC(22:6(4Z,7Z,10Z,13Z,16Z,19Z)), in particular, consists of one chain of docosahexaenoic acid at the C-1 position. The docosahexaenoic acid moiety is derived from fish oils. Lysophosphatidylcholine is found in small amounts in most tissues. It is formed by hydrolysis of phosphatidylcholine by the enzyme phospholipase A2, as part of the de-acylation/re-acylation cycle that controls its overall molecular species composition. It can also be formed inadvertently during extraction of lipids from tissues if the phospholipase is activated by careless handling. In blood plasma significant amounts of lysophosphatidylcholine are formed by a specific enzyme system, lecithin:cholesterol acyltransferase (LCAT), which is secreted from the liver. The enzyme catalyzes the transfer of the fatty acids of position sn-2 of phosphatidylcholine to the free cholesterol in plasma, with formation of cholesterol esters and lysophosphatidylcholine. Lysophospholipids have a role in lipid signaling by acting on lysophospholipid receptors (LPL-R). LPL-Rs are members of the G protein-coupled receptor family of integral membrane proteins.

   

1-Heneicosanoyl-glycero-3-phosphoserine

2-amino-3-({[3-(henicosanoyloxy)-2-hydroxypropoxy](hydroxy)phosphoryl}oxy)propanoic acid

C27H54NO9P (567.3536004)


   

Penitrem D

14,15,32,32-Tetramethyl-23-methylidene-9-prop-1-en-2-yl-10,31-dioxa-17-azanonacyclo[24.4.2.02,15.05,14.06,11.016,30.018,29.021,28.024,27]dotriaconta-6,16(30),18(29),19,21(28)-pentaene-5,8-diol

C37H45NO4 (567.334841)


   
   
   
   
   

Tetradehydrolongicaudatine Y

Tetradehydrolongicaudatine Y

C38H39N4O (567.3123704)


   

Phosphatidylcholine lyso 22:6

Phosphatidylcholine lyso 22:6

C30H50NO7P (567.332472)


   
   
   
   

emindole SB beta-mannoside

emindole SB beta-mannoside

C34H49NO6 (567.3559694)


   
   
   
   

Nelfinavir

Nelfinavir

C32H45N3O4S (567.3130610000001)


J - Antiinfectives for systemic use > J05 - Antivirals for systemic use > J05A - Direct acting antivirals > J05AE - Protease inhibitors D000890 - Anti-Infective Agents > D000998 - Antiviral Agents > D000084762 - Viral Protease Inhibitors D000890 - Anti-Infective Agents > D000998 - Antiviral Agents > D044966 - Anti-Retroviral Agents C471 - Enzyme Inhibitor > C783 - Protease Inhibitor > C97366 - HIV Protease Inhibitor C254 - Anti-Infective Agent > C281 - Antiviral Agent > C1660 - Anti-HIV Agent D004791 - Enzyme Inhibitors > D011480 - Protease Inhibitors

   

3,4,5,6-tetradehydrolongicaudatine Y

3,4,5,6-tetradehydrolongicaudatine Y

[C38H39N4O]+ (567.3123704)


   

Phe Phe Arg Val

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-3-phenylpropanamido]-5-carbamimidamidopentanamido]-3-methylbutanoic acid

C29H41N7O5 (567.3169016)


   

Phe Phe Val Arg

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-3-phenylpropanamido]-3-methylbutanamido]-5-carbamimidamidopentanoic acid

C29H41N7O5 (567.3169016)


   

Phe Arg Phe Val

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-5-carbamimidamidopentanamido]-3-phenylpropanamido]-3-methylbutanoic acid

C29H41N7O5 (567.3169016)


   

Phe Arg Val Phe

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-5-carbamimidamidopentanamido]-3-methylbutanamido]-3-phenylpropanoic acid

C29H41N7O5 (567.3169016)


   

Phe Val Phe Arg

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-3-methylbutanamido]-3-phenylpropanamido]-5-carbamimidamidopentanoic acid

C29H41N7O5 (567.3169016)


   

Phe Val Arg Phe

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-phenylpropanamido]-3-methylbutanamido]-5-carbamimidamidopentanamido]-3-phenylpropanoic acid

C29H41N7O5 (567.3169016)


   

His Ile Ile Trp

(2S)-2-[(2S,3S)-2-[(2S,3S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-methylpentanamido]-3-methylpentanamido]-3-(1H-indol-3-yl)propanoic acid

C29H41N7O5 (567.3169016)


   

His Ile Leu Trp

(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-methylpentanamido]-4-methylpentanamido]-3-(1H-indol-3-yl)propanoic acid

C29H41N7O5 (567.3169016)


   

His Ile Trp Ile

(2S,3S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-methylpentanamido]-3-(1H-indol-3-yl)propanamido]-3-methylpentanoic acid

C29H41N7O5 (567.3169016)


   

His Ile Trp Leu

(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-methylpentanamido]-3-(1H-indol-3-yl)propanamido]-4-methylpentanoic acid

C29H41N7O5 (567.3169016)


   

His Lys Lys Arg

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

C24H45N11O5 (567.360496)


   

His Lys Gln Arg

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

C23H41N11O6 (567.3241126)


   

His Lys Arg Lys

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

C24H45N11O5 (567.360496)


   

His Lys Arg Gln

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

C23H41N11O6 (567.3241126)


   

His Leu Ile Trp

(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-4-methylpentanamido]-3-methylpentanamido]-3-(1H-indol-3-yl)propanoic acid

C29H41N7O5 (567.3169016)


   

His Leu Leu Trp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-4-methylpentanamido]-4-methylpentanamido]-3-(1H-indol-3-yl)propanoic acid

C29H41N7O5 (567.3169016)


   

His Leu Trp Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-4-methylpentanamido]-3-(1H-indol-3-yl)propanamido]-3-methylpentanoic acid

C29H41N7O5 (567.3169016)


   

His Leu Trp Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-4-methylpentanamido]-3-(1H-indol-3-yl)propanamido]-4-methylpentanoic acid

C29H41N7O5 (567.3169016)


   

His Gln Lys Arg

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

C23H41N11O6 (567.3241126)


   

His Gln Arg Lys

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

C23H41N11O6 (567.3241126)


   

His Arg Lys Lys

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

C24H45N11O5 (567.360496)


   

His Arg Lys Gln

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

C23H41N11O6 (567.3241126)


   

His Arg Gln Lys

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

C23H41N11O6 (567.3241126)


   

His Trp Ile Ile

(2S,3S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-(1H-indol-3-yl)propanamido]-3-methylpentanamido]-3-methylpentanoic acid

C29H41N7O5 (567.3169016)


   

His Trp Ile Leu

(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-(1H-indol-3-yl)propanamido]-3-methylpentanamido]-4-methylpentanoic acid

C29H41N7O5 (567.3169016)


   

His Trp Leu Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-(1H-indol-3-yl)propanamido]-4-methylpentanamido]-3-methylpentanoic acid

C29H41N7O5 (567.3169016)


   

His Trp Leu Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-imidazol-4-yl)propanamido]-3-(1H-indol-3-yl)propanamido]-4-methylpentanamido]-4-methylpentanoic acid

C29H41N7O5 (567.3169016)


   

Ile His Ile Trp

(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-3-(1H-imidazol-4-yl)propanamido]-3-methylpentanamido]-3-(1H-indol-3-yl)propanoic acid

C29H41N7O5 (567.3169016)


   

Ile His Leu Trp

(2S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-3-(1H-imidazol-4-yl)propanamido]-4-methylpentanamido]-3-(1H-indol-3-yl)propanoic acid

C29H41N7O5 (567.3169016)


   

Ile His Trp Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-3-(1H-imidazol-4-yl)propanamido]-3-(1H-indol-3-yl)propanamido]-3-methylpentanoic acid

C29H41N7O5 (567.3169016)


   

Ile His Trp Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-3-(1H-imidazol-4-yl)propanamido]-3-(1H-indol-3-yl)propanamido]-4-methylpentanoic acid

C29H41N7O5 (567.3169016)


   

Ile Ile His Trp

(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-3-methylpentanamido]-3-(1H-imidazol-4-yl)propanamido]-3-(1H-indol-3-yl)propanoic acid

C29H41N7O5 (567.3169016)


   

Ile Ile Trp His

(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-3-methylpentanamido]-3-(1H-indol-3-yl)propanamido]-3-(1H-imidazol-4-yl)propanoic acid

C29H41N7O5 (567.3169016)


   

Ile Leu His Trp

(2S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-4-methylpentanamido]-3-(1H-imidazol-4-yl)propanamido]-3-(1H-indol-3-yl)propanoic acid

C29H41N7O5 (567.3169016)


   

Ile Leu Trp His

(2S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-4-methylpentanamido]-3-(1H-indol-3-yl)propanamido]-3-(1H-imidazol-4-yl)propanoic acid

C29H41N7O5 (567.3169016)


   

Ile Trp His Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-3-(1H-indol-3-yl)propanamido]-3-(1H-imidazol-4-yl)propanamido]-3-methylpentanoic acid

C29H41N7O5 (567.3169016)


   

Ile Trp His Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-3-(1H-indol-3-yl)propanamido]-3-(1H-imidazol-4-yl)propanamido]-4-methylpentanoic acid

C29H41N7O5 (567.3169016)


   

Ile Trp Ile His

(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-3-(1H-indol-3-yl)propanamido]-3-methylpentanamido]-3-(1H-imidazol-4-yl)propanoic acid

C29H41N7O5 (567.3169016)


   

Ile Trp Leu His

(2S)-2-[(2S)-2-[(2S)-2-[(2S,3S)-2-amino-3-methylpentanamido]-3-(1H-indol-3-yl)propanamido]-4-methylpentanamido]-3-(1H-imidazol-4-yl)propanoic acid

C29H41N7O5 (567.3169016)


   

Lys His Lys Arg

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

C24H45N11O5 (567.360496)


   

Lys His Gln Arg

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

C23H41N11O6 (567.3241126)


   

Lys His Arg Lys

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

C24H45N11O5 (567.360496)


   

Lys His Arg Gln

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

C23H41N11O6 (567.3241126)


   

Lys Lys His Arg

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

C24H45N11O5 (567.360496)


   

Lys Lys Arg His

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

C24H45N11O5 (567.360496)


   

Lys Gln His Arg

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

C23H41N11O6 (567.3241126)


   

Lys Gln Arg His

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

C23H41N11O6 (567.3241126)


   

Lys Arg His Lys

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

C24H45N11O5 (567.360496)


   

Lys Arg His Gln

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

C23H41N11O6 (567.3241126)


   

Lys Arg Lys His

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

C24H45N11O5 (567.360496)


   

Lys Arg Gln His

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

C23H41N11O6 (567.3241126)


   

Leu His Ile Trp

(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-3-(1H-imidazol-4-yl)propanamido]-3-methylpentanamido]-3-(1H-indol-3-yl)propanoic acid

C29H41N7O5 (567.3169016)


   

Leu His Leu Trp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-3-(1H-imidazol-4-yl)propanamido]-4-methylpentanamido]-3-(1H-indol-3-yl)propanoic acid

C29H41N7O5 (567.3169016)


   

Leu His Trp Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-3-(1H-imidazol-4-yl)propanamido]-3-(1H-indol-3-yl)propanamido]-3-methylpentanoic acid

C29H41N7O5 (567.3169016)


   

Leu His Trp Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-3-(1H-imidazol-4-yl)propanamido]-3-(1H-indol-3-yl)propanamido]-4-methylpentanoic acid

C29H41N7O5 (567.3169016)


   

Leu Ile His Trp

(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-amino-4-methylpentanamido]-3-methylpentanamido]-3-(1H-imidazol-4-yl)propanamido]-3-(1H-indol-3-yl)propanoic acid

C29H41N7O5 (567.3169016)


   

Leu Ile Trp His

(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-amino-4-methylpentanamido]-3-methylpentanamido]-3-(1H-indol-3-yl)propanamido]-3-(1H-imidazol-4-yl)propanoic acid

C29H41N7O5 (567.3169016)


   

Leu Leu His Trp

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-4-methylpentanamido]-3-(1H-imidazol-4-yl)propanamido]-3-(1H-indol-3-yl)propanoic acid

C29H41N7O5 (567.3169016)


   

Leu Leu Trp His

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-4-methylpentanamido]-3-(1H-indol-3-yl)propanamido]-3-(1H-imidazol-4-yl)propanoic acid

C29H41N7O5 (567.3169016)


   

Leu Trp His Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-3-(1H-indol-3-yl)propanamido]-3-(1H-imidazol-4-yl)propanamido]-3-methylpentanoic acid

C29H41N7O5 (567.3169016)


   

Leu Trp His Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-3-(1H-indol-3-yl)propanamido]-3-(1H-imidazol-4-yl)propanamido]-4-methylpentanoic acid

C29H41N7O5 (567.3169016)


   

Leu Trp Ile His

(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-3-(1H-indol-3-yl)propanamido]-3-methylpentanamido]-3-(1H-imidazol-4-yl)propanoic acid

C29H41N7O5 (567.3169016)


   

Leu Trp Leu His

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-4-methylpentanamido]-3-(1H-indol-3-yl)propanamido]-4-methylpentanamido]-3-(1H-imidazol-4-yl)propanoic acid

C29H41N7O5 (567.3169016)


   

Gln His Lys Arg

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

C23H41N11O6 (567.3241126)


   

Gln His Arg Lys

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

C23H41N11O6 (567.3241126)


   

Gln Lys His Arg

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

C23H41N11O6 (567.3241126)


   

Gln Lys Arg His

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

C23H41N11O6 (567.3241126)


   

Gln Arg His Lys

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

C23H41N11O6 (567.3241126)


   

Gln Arg Lys His

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

C23H41N11O6 (567.3241126)


   

Arg Phe Phe Val

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-3-phenylpropanamido]-3-phenylpropanamido]-3-methylbutanoic acid

C29H41N7O5 (567.3169016)


   

Arg Phe Val Phe

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-3-phenylpropanamido]-3-methylbutanamido]-3-phenylpropanoic acid

C29H41N7O5 (567.3169016)


   

Arg His Lys Lys

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

C24H45N11O5 (567.360496)


   

Arg His Lys Gln

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

C23H41N11O6 (567.3241126)


   

Arg His Gln Lys

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

C23H41N11O6 (567.3241126)


   

Arg Lys His Lys

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

C24H45N11O5 (567.360496)


   

Arg Lys His Gln

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

C23H41N11O6 (567.3241126)


   

Arg Lys Lys His

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

C24H45N11O5 (567.360496)


   

Arg Lys Gln His

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

C23H41N11O6 (567.3241126)


   

Arg Gln His Lys

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

C23H41N11O6 (567.3241126)


   

Arg Gln Lys His

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

C23H41N11O6 (567.3241126)


   

Arg Val Phe Phe

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-5-carbamimidamidopentanamido]-3-methylbutanamido]-3-phenylpropanamido]-3-phenylpropanoic acid

C29H41N7O5 (567.3169016)


   

Val Phe Phe Arg

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]-3-phenylpropanamido]-3-phenylpropanamido]-5-carbamimidamidopentanoic acid

C29H41N7O5 (567.3169016)


   

Val Phe Arg Phe

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]-3-phenylpropanamido]-5-carbamimidamidopentanamido]-3-phenylpropanoic acid

C29H41N7O5 (567.3169016)


   

Val Arg Phe Phe

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]-5-carbamimidamidopentanamido]-3-phenylpropanamido]-3-phenylpropanoic acid

C29H41N7O5 (567.3169016)


   

Trp His Ile Ile

(2S,3S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-3-(1H-imidazol-4-yl)propanamido]-3-methylpentanamido]-3-methylpentanoic acid

C29H41N7O5 (567.3169016)


   

Trp His Ile Leu

(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-3-(1H-imidazol-4-yl)propanamido]-3-methylpentanamido]-4-methylpentanoic acid

C29H41N7O5 (567.3169016)


   

Trp His Leu Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-3-(1H-imidazol-4-yl)propanamido]-4-methylpentanamido]-3-methylpentanoic acid

C29H41N7O5 (567.3169016)


   

Trp His Leu Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-3-(1H-imidazol-4-yl)propanamido]-4-methylpentanamido]-4-methylpentanoic acid

C29H41N7O5 (567.3169016)


   

Trp Ile His Ile

(2S,3S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-3-methylpentanamido]-3-(1H-imidazol-4-yl)propanamido]-3-methylpentanoic acid

C29H41N7O5 (567.3169016)


   

Trp Ile His Leu

(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-3-methylpentanamido]-3-(1H-imidazol-4-yl)propanamido]-4-methylpentanoic acid

C29H41N7O5 (567.3169016)


   

Trp Ile Ile His

(2S)-2-[(2S,3S)-2-[(2S,3S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-3-methylpentanamido]-3-methylpentanamido]-3-(1H-imidazol-4-yl)propanoic acid

C29H41N7O5 (567.3169016)


   

Trp Ile Leu His

(2S)-2-[(2S)-2-[(2S,3S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-3-methylpentanamido]-4-methylpentanamido]-3-(1H-imidazol-4-yl)propanoic acid

C29H41N7O5 (567.3169016)


   

Trp Leu His Ile

(2S,3S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-4-methylpentanamido]-3-(1H-imidazol-4-yl)propanamido]-3-methylpentanoic acid

C29H41N7O5 (567.3169016)


   

Trp Leu His Leu

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-4-methylpentanamido]-3-(1H-imidazol-4-yl)propanamido]-4-methylpentanoic acid

C29H41N7O5 (567.3169016)


   

Trp Leu Ile His

(2S)-2-[(2S,3S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-4-methylpentanamido]-3-methylpentanamido]-3-(1H-imidazol-4-yl)propanoic acid

C29H41N7O5 (567.3169016)


   

Trp Leu Leu His

(2S)-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]-4-methylpentanamido]-4-methylpentanamido]-3-(1H-imidazol-4-yl)propanoic acid

C29H41N7O5 (567.3169016)


   

HGKKV

His-Gly-Lys-Lys-Val

C25H45N9O6 (567.3492630000001)


   

LIPLL

Leu-Ile-Pro-Leu-Leu

C29H53N5O6 (567.3995638)


   

PC(22:6/0:0)[U]

3,5,9-Trioxa-4-phosphahentriaconta-13,16,19,22,25,28-hexaen-1-aminium, 4,7-dihydroxy-N,N,N-trimethyl-10-oxo-, inner salt, 4-oxide

C30H50NO7P (567.332472)


   

PC(22:6/0:0)

3,5,9-Trioxa-4-phosphahentriaconta-13,16,19,22,25,28-hexaen-1-aminium, 4,7-dihydroxy-N,N,N-trimethyl-10-oxo-, inner salt, 4-oxide, [R-(all-Z)]-

C30H50NO7P (567.332472)


   

Didecanoylphosphatidylserine

L-Serine, 2,3-bis[(1-oxodecyl)oxy]propyl hydrogen phosphate (ester), (R)-

C26H50NO10P (567.317217)


   

LPC(22:6)

1-Docosahexaenoyl-glycero-3-phosphocholine

C30H50NO7P (567.332472)


   

PS(21:0/0:0)

1-heneicosanoyl-glycero-3-phosphoserine

C27H54NO9P (567.3536004)


   

LPC 22:6

1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphocholine

C30H50NO7P (567.332472)


   

PS 20:0

L-Serine, 2,3-bis[(1-oxodecyl)oxy]propyl hydrogen phosphate (ester), (R)-

C26H50NO10P (567.317217)


   

LPS 21:0

1-heneicosanoyl-glycero-3-phosphoserine

C27H54NO9P (567.3536004)


   

PG-PE

1-hexadecanoyl-2-glutaryl-sn-glycero-phosphoethanolamine

C26H50NO10P (567.317217)


   

7-[4-(diethylamino)-2-ethoxyphenyl]-7-(2-methyl-1-octylindol-3-yl)furo[3,4-b]pyridin-5-one

7-[4-(diethylamino)-2-ethoxyphenyl]-7-(2-methyl-1-octylindol-3-yl)furo[3,4-b]pyridin-5-one

C36H45N3O3 (567.3460739999999)


   
   

6alpha-Glucuronosylhyodeoxycholate

6alpha-Glucuronosylhyodeoxycholate

C30H47O10- (567.3169062)


   

(2R,3R,7R,8S,9S,10S,12R,14E)-9-[(2R,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-3,10-diethyl-7-hydroxy-2,8,12,16-tetramethyl-4,17-dioxabicyclo[14.1.0]heptadec-14-ene-5,13-dione

(2R,3R,7R,8S,9S,10S,12R,14E)-9-[(2R,3R,4S,6R)-4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy-3,10-diethyl-7-hydroxy-2,8,12,16-tetramethyl-4,17-dioxabicyclo[14.1.0]heptadec-14-ene-5,13-dione

C31H53NO8 (567.3770978)


   

rel-sodium 2-((1S,4R,5aS,5bR,7aS,11aS,11bR,13R,13aS)-13-acetoxy-1,4-dimethoxy-5b,8,8,11a,13a-pentamethyl-3-oxo-5,5a,6,7,7a,8,9,10,11,11a,11b,12,13,13a-tetradecahydro-1H-phenanthro[2,1-e]isoindol-2(3H,4H,5bH)-yl)acetate

rel-sodium 2-((1S,4R,5aS,5bR,7aS,11aS,11bR,13R,13aS)-13-acetoxy-1,4-dimethoxy-5b,8,8,11a,13a-pentamethyl-3-oxo-5,5a,6,7,7a,8,9,10,11,11a,11b,12,13,13a-tetradecahydro-1H-phenanthro[2,1-e]isoindol-2(3H,4H,5bH)-yl)acetate

C31H46NNaO7 (567.3171806)


A natural product found in Hyattella species.

   

2-(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl-sn-glycero-3-phosphocholine

2-(4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl-sn-glycero-3-phosphocholine

C30H50NO7P (567.332472)


A lysophosphatidylcholine 22:6 in which the acyl group is specified as (4Z,7Z,10Z,13Z,16Z,19Z)-docosahexaenoyl and is located at position 2.

   

1-O-(3alpha,7alpha-dihydroxy-24-oxo-5beta-cholan-24-yl)-beta-D-glucopyranuronate

1-O-(3alpha,7alpha-dihydroxy-24-oxo-5beta-cholan-24-yl)-beta-D-glucopyranuronate

C30H47O10- (567.3169062)


   

1-O-(3alpha,12alpha-dihydroxy-24-oxo-5beta-cholan-24-yl)-beta-D-glucopyranuronate

1-O-(3alpha,12alpha-dihydroxy-24-oxo-5beta-cholan-24-yl)-beta-D-glucopyranuronate

C30H47O10- (567.3169062)


   

1-O-(3alpha,6alpha-dihydroxy-24-oxo-5beta-cholan-24-yl)-beta-D-glucopyranuronate

1-O-(3alpha,6alpha-dihydroxy-24-oxo-5beta-cholan-24-yl)-beta-D-glucopyranuronate

C30H47O10- (567.3169062)


   

3,4,5,6-tetradehydrolongicaudatine Y

3,4,5,6-tetradehydrolongicaudatine Y

C38H39N4O+ (567.3123704)


   

N-[(3R,9S,10R)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-2-phenylacetamide

N-[(3R,9S,10R)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-2-phenylacetamide

C33H49N3O5 (567.3672024)


   

N-[(3S,9S,10R)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-2-phenylacetamide

N-[(3S,9S,10R)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-2-phenylacetamide

C33H49N3O5 (567.3672024)


   

N-[(3R,9R,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-2-phenylacetamide

N-[(3R,9R,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-2-phenylacetamide

C33H49N3O5 (567.3672024)


   

N-[(3R,9S,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-2-phenylacetamide

N-[(3R,9S,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-2-phenylacetamide

C33H49N3O5 (567.3672024)


   

N-[(3S,9R,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-2-phenylacetamide

N-[(3S,9R,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-2-phenylacetamide

C33H49N3O5 (567.3672024)


   

N-[(3S,9S,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-2-phenylacetamide

N-[(3S,9S,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-2-phenylacetamide

C33H49N3O5 (567.3672024)


   

N-[(3S,9R,10S)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-2-phenylacetamide

N-[(3S,9R,10S)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(propyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]-2-phenylacetamide

C33H49N3O5 (567.3672024)


   

(3S,4aR,8aR)-N-tert-butyl-2-[(2R,3R)-2-hydroxy-3-[(3-hydroxy-2-methylbenzoyl)amino]-4-phenylsulfanylbutyl]-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-3-carboxamide

(3S,4aR,8aR)-N-tert-butyl-2-[(2R,3R)-2-hydroxy-3-[(3-hydroxy-2-methylbenzoyl)amino]-4-phenylsulfanylbutyl]-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-3-carboxamide

C32H45N3O4S (567.3130610000001)


   

[3-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoyl]oxy-2-hydroxypropyl] 2-(trimethylazaniumyl)ethyl phosphate

[3-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoyl]oxy-2-hydroxypropyl] 2-(trimethylazaniumyl)ethyl phosphate

C30H50NO7P (567.332472)


   

2-Amino-3-[2,3-di(decanoyloxy)propoxy-hydroxyphosphoryl]oxypropanoic acid

2-Amino-3-[2,3-di(decanoyloxy)propoxy-hydroxyphosphoryl]oxypropanoic acid

C26H50NO10P (567.317217)


   
   
   
   
   
   
   
   
   
   
   
   
   
   
   
   
   
   
   
   

(4E,8E,12E)-3-hydroxy-2-[[(4Z,7Z)-2-hydroxyhexadeca-4,7-dienoyl]amino]pentadeca-4,8,12-triene-1-sulfonic acid

(4E,8E,12E)-3-hydroxy-2-[[(4Z,7Z)-2-hydroxyhexadeca-4,7-dienoyl]amino]pentadeca-4,8,12-triene-1-sulfonic acid

C31H53NO6S (567.3593398)


   

2-[[(10Z,13Z,16Z,19Z)-docosa-10,13,16,19-tetraenoyl]amino]-3-hydroxydecane-1-sulfonic acid

2-[[(10Z,13Z,16Z,19Z)-docosa-10,13,16,19-tetraenoyl]amino]-3-hydroxydecane-1-sulfonic acid

C32H57NO5S (567.3957232)


   

(4E,8E,12E)-3-hydroxy-2-[[(Z)-pentadec-9-enoyl]amino]heptadeca-4,8,12-triene-1-sulfonic acid

(4E,8E,12E)-3-hydroxy-2-[[(Z)-pentadec-9-enoyl]amino]heptadeca-4,8,12-triene-1-sulfonic acid

C32H57NO5S (567.3957232)


   

(4E,8E)-2-[[(9Z,12Z)-hexadeca-9,12-dienoyl]amino]-3-hydroxyhexadeca-4,8-diene-1-sulfonic acid

(4E,8E)-2-[[(9Z,12Z)-hexadeca-9,12-dienoyl]amino]-3-hydroxyhexadeca-4,8-diene-1-sulfonic acid

C32H57NO5S (567.3957232)


   

(4E,8E)-2-[[(9Z,12Z)-heptadeca-9,12-dienoyl]amino]-3-hydroxypentadeca-4,8-diene-1-sulfonic acid

(4E,8E)-2-[[(9Z,12Z)-heptadeca-9,12-dienoyl]amino]-3-hydroxypentadeca-4,8-diene-1-sulfonic acid

C32H57NO5S (567.3957232)


   

(4E,8E)-3-hydroxy-2-[[(9Z,12Z)-octadeca-9,12-dienoyl]amino]tetradeca-4,8-diene-1-sulfonic acid

(4E,8E)-3-hydroxy-2-[[(9Z,12Z)-octadeca-9,12-dienoyl]amino]tetradeca-4,8-diene-1-sulfonic acid

C32H57NO5S (567.3957232)


   

(4E,8E,12E)-3-hydroxy-2-[[(Z)-octadec-9-enoyl]amino]tetradeca-4,8,12-triene-1-sulfonic acid

(4E,8E,12E)-3-hydroxy-2-[[(Z)-octadec-9-enoyl]amino]tetradeca-4,8,12-triene-1-sulfonic acid

C32H57NO5S (567.3957232)


   

(4E,8E)-3-hydroxy-2-[[(9Z,12Z)-nonadeca-9,12-dienoyl]amino]trideca-4,8-diene-1-sulfonic acid

(4E,8E)-3-hydroxy-2-[[(9Z,12Z)-nonadeca-9,12-dienoyl]amino]trideca-4,8-diene-1-sulfonic acid

C32H57NO5S (567.3957232)


   

(E)-2-[[(7Z,10Z,13Z)-hexadeca-7,10,13-trienoyl]amino]-3-hydroxyhexadec-4-ene-1-sulfonic acid

(E)-2-[[(7Z,10Z,13Z)-hexadeca-7,10,13-trienoyl]amino]-3-hydroxyhexadec-4-ene-1-sulfonic acid

C32H57NO5S (567.3957232)


   

3-hydroxy-2-[[(6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoyl]amino]tetradecane-1-sulfonic acid

3-hydroxy-2-[[(6Z,9Z,12Z,15Z)-octadeca-6,9,12,15-tetraenoyl]amino]tetradecane-1-sulfonic acid

C32H57NO5S (567.3957232)


   

(E)-3-hydroxy-2-[[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]amino]tetradec-4-ene-1-sulfonic acid

(E)-3-hydroxy-2-[[(9Z,12Z,15Z)-octadeca-9,12,15-trienoyl]amino]tetradec-4-ene-1-sulfonic acid

C32H57NO5S (567.3957232)


   

2-[[(4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoyl]amino]-3-hydroxyhexadecane-1-sulfonic acid

2-[[(4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoyl]amino]-3-hydroxyhexadecane-1-sulfonic acid

C32H57NO5S (567.3957232)


   

3-hydroxy-2-[[(8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoyl]amino]dodecane-1-sulfonic acid

3-hydroxy-2-[[(8Z,11Z,14Z,17Z)-icosa-8,11,14,17-tetraenoyl]amino]dodecane-1-sulfonic acid

C32H57NO5S (567.3957232)


   

(4E,8E,12E)-3-hydroxy-2-[[(Z)-tetradec-9-enoyl]amino]octadeca-4,8,12-triene-1-sulfonic acid

(4E,8E,12E)-3-hydroxy-2-[[(Z)-tetradec-9-enoyl]amino]octadeca-4,8,12-triene-1-sulfonic acid

C32H57NO5S (567.3957232)


   

(4E,8E,12E)-2-[[(Z)-hexadec-9-enoyl]amino]-3-hydroxyhexadeca-4,8,12-triene-1-sulfonic acid

(4E,8E,12E)-2-[[(Z)-hexadec-9-enoyl]amino]-3-hydroxyhexadeca-4,8,12-triene-1-sulfonic acid

C32H57NO5S (567.3957232)


   

(4E,8E,12E)-2-[[(Z)-heptadec-9-enoyl]amino]-3-hydroxypentadeca-4,8,12-triene-1-sulfonic acid

(4E,8E,12E)-2-[[(Z)-heptadec-9-enoyl]amino]-3-hydroxypentadeca-4,8,12-triene-1-sulfonic acid

C32H57NO5S (567.3957232)


   

(E)-2-[[(10Z,13Z,16Z)-docosa-10,13,16-trienoyl]amino]-3-hydroxydec-4-ene-1-sulfonic acid

(E)-2-[[(10Z,13Z,16Z)-docosa-10,13,16-trienoyl]amino]-3-hydroxydec-4-ene-1-sulfonic acid

C32H57NO5S (567.3957232)


   

(E)-3-hydroxy-2-[[(11Z,14Z,17Z)-icosa-11,14,17-trienoyl]amino]dodec-4-ene-1-sulfonic acid

(E)-3-hydroxy-2-[[(11Z,14Z,17Z)-icosa-11,14,17-trienoyl]amino]dodec-4-ene-1-sulfonic acid

C32H57NO5S (567.3957232)


   

(4E,8E)-3-hydroxy-2-[[(11Z,14Z)-icosa-11,14-dienoyl]amino]dodeca-4,8-diene-1-sulfonic acid

(4E,8E)-3-hydroxy-2-[[(11Z,14Z)-icosa-11,14-dienoyl]amino]dodeca-4,8-diene-1-sulfonic acid

C32H57NO5S (567.3957232)


   

(4E,8E,12E)-3-hydroxy-2-[[(Z)-tridec-9-enoyl]amino]nonadeca-4,8,12-triene-1-sulfonic acid

(4E,8E,12E)-3-hydroxy-2-[[(Z)-tridec-9-enoyl]amino]nonadeca-4,8,12-triene-1-sulfonic acid

C32H57NO5S (567.3957232)


   

2-Amino-3-[(3-decoxy-2-undecanoyloxypropoxy)-hydroxyphosphoryl]oxypropanoic acid

2-Amino-3-[(3-decoxy-2-undecanoyloxypropoxy)-hydroxyphosphoryl]oxypropanoic acid

C27H54NO9P (567.3536004)


   

2-Amino-3-[(2-decanoyloxy-3-undecoxypropoxy)-hydroxyphosphoryl]oxypropanoic acid

2-Amino-3-[(2-decanoyloxy-3-undecoxypropoxy)-hydroxyphosphoryl]oxypropanoic acid

C27H54NO9P (567.3536004)


   
   

[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoxy]propan-2-yl] propanoate

[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoxy]propan-2-yl] propanoate

C30H50NO7P (567.332472)


   

2-Amino-3-[hydroxy-(3-nonanoyloxy-2-undecanoyloxypropoxy)phosphoryl]oxypropanoic acid

2-Amino-3-[hydroxy-(3-nonanoyloxy-2-undecanoyloxypropoxy)phosphoryl]oxypropanoic acid

C26H50NO10P (567.317217)


   

2-Amino-3-[(2-heptadecanoyloxy-3-propanoyloxypropoxy)-hydroxyphosphoryl]oxypropanoic acid

2-Amino-3-[(2-heptadecanoyloxy-3-propanoyloxypropoxy)-hydroxyphosphoryl]oxypropanoic acid

C26H50NO10P (567.317217)


   

2-Amino-3-[hydroxy-(2-pentadecanoyloxy-3-pentanoyloxypropoxy)phosphoryl]oxypropanoic acid

2-Amino-3-[hydroxy-(2-pentadecanoyloxy-3-pentanoyloxypropoxy)phosphoryl]oxypropanoic acid

C26H50NO10P (567.317217)


   

2-Amino-3-[(3-heptanoyloxy-2-tridecanoyloxypropoxy)-hydroxyphosphoryl]oxypropanoic acid

2-Amino-3-[(3-heptanoyloxy-2-tridecanoyloxypropoxy)-hydroxyphosphoryl]oxypropanoic acid

C26H50NO10P (567.317217)


   

2-Amino-3-[(2-dodecanoyloxy-3-octanoyloxypropoxy)-hydroxyphosphoryl]oxypropanoic acid

2-Amino-3-[(2-dodecanoyloxy-3-octanoyloxypropoxy)-hydroxyphosphoryl]oxypropanoic acid

C26H50NO10P (567.317217)


   

2-Amino-3-[(3-hexanoyloxy-2-tetradecanoyloxypropoxy)-hydroxyphosphoryl]oxypropanoic acid

2-Amino-3-[(3-hexanoyloxy-2-tetradecanoyloxypropoxy)-hydroxyphosphoryl]oxypropanoic acid

C26H50NO10P (567.317217)


   

2-Amino-3-[(3-butanoyloxy-2-hexadecanoyloxypropoxy)-hydroxyphosphoryl]oxypropanoic acid

2-Amino-3-[(3-butanoyloxy-2-hexadecanoyloxypropoxy)-hydroxyphosphoryl]oxypropanoic acid

C26H50NO10P (567.317217)


   

3-[(3-Acetyloxy-2-octadecanoyloxypropoxy)-hydroxyphosphoryl]oxy-2-aminopropanoic acid

3-[(3-Acetyloxy-2-octadecanoyloxypropoxy)-hydroxyphosphoryl]oxy-2-aminopropanoic acid

C26H50NO10P (567.317217)


   

1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphocholine

1-(4Z,7Z,10Z,13Z,16Z,19Z-docosahexaenoyl)-sn-glycero-3-phosphocholine

C30H50NO7P (567.332472)


A lysophosphatidylcholine 22:6 in which the remaining acyl group is (4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoyl.

   

N-tert-butyl-2-[2-hydroxy-3-[(3-hydroxy-2-methylbenzoyl)amino]-4-phenylsulfanylbutyl]-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-3-carboxamide

N-tert-butyl-2-[2-hydroxy-3-[(3-hydroxy-2-methylbenzoyl)amino]-4-phenylsulfanylbutyl]-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-3-carboxamide

C32H45N3O4S (567.3130610000001)


   

1,2-didecanoyl-sn-glycero-3-phosphoserine

1,2-didecanoyl-sn-glycero-3-phosphoserine

C26H50NO10P (567.317217)


   

1-palmitoyl-2-glutaryl-sn-glycero-phosphoethanolamine

1-palmitoyl-2-glutaryl-sn-glycero-phosphoethanolamine

C26H50NO10P (567.317217)


   

1-heneicosanoyl-glycero-3-phosphoserine

1-heneicosanoyl-glycero-3-phosphoserine

C27H54NO9P (567.3536004)


   

lysophosphatidylcholine 22:6

lysophosphatidylcholine 22:6

C30H50NO7P (567.332472)


An acyl-sn-glycero-3-phosphocholine in which the acyl group (position not specified) contains 22 carbons with 6 double bonds.

   

1-Docosahexaenoyl-sn-glycero-3-phosphocholine

1-Docosahexaenoyl-sn-glycero-3-phosphocholine

C30H50NO7P (567.332472)


A lysophosphatidylcholine 22:6 in which the docosahexaenoyl group is located at position 1.

   

2-docosahexaenoyl-sn-glycero-3-phosphocholine

2-docosahexaenoyl-sn-glycero-3-phosphocholine

C30H50NO7P (567.332472)


A lysophosphatidylcholine 22:6 in which the acyl group is specified as docosahexaenoyl and is located at position 2.

   

chenodeoxycholic acid 24-O-(beta-D-glucuronide)(1-)

chenodeoxycholic acid 24-O-(beta-D-glucuronide)(1-)

C30H47O10 (567.3169062)


A steroid glucuronide anion that is the conjugate base of chenodeoxycholic acid 24-O-(beta-D-glucuronide) arising from deprotonation of the carboxylic acid function; major species at pH 7.3.

   

deoxycholic acid 24-O-(beta-D-glucuronide)(1-)

deoxycholic acid 24-O-(beta-D-glucuronide)(1-)

C30H47O10 (567.3169062)


A steroid glucuronide anion that is the conjugate base of deoxycholic acid 24-O-(beta-D-glucuronide) arising from deprotonation of the carboxylic acid function; major species at pH 7.3.

   

hyodeoxycholic acid 24-O-(beta-D-glucuronide)(1-)

hyodeoxycholic acid 24-O-(beta-D-glucuronide)(1-)

C30H47O10 (567.3169062)


A steroid glucuronide anion that is the conjugate base of hyodeoxycholic acid 24-O-(beta-D-glucuronide) arising from deprotonation of the carboxylic acid function; major species at pH 7.3.

   
   
   
   
   
   
   
   
   
   
   
   
   
   
   
   
   
   
   
   
   
   
   
   
   
   
   
   
   
   

(1s,2r,3r,4s,5r,6s,8r,9r,10r,13s,16s,17r,18r)-11-ethyl-8,18-dihydroxy-6,16-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl (2e)-3-phenylprop-2-enoate

(1s,2r,3r,4s,5r,6s,8r,9r,10r,13s,16s,17r,18r)-11-ethyl-8,18-dihydroxy-6,16-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl (2e)-3-phenylprop-2-enoate

C33H45NO7 (567.3195860000001)


   

(1s,2r,5s,8r,9r,11s,14r,15s,24s,26s,27s)-14,15,32,32-tetramethyl-23-methylidene-9-(prop-1-en-2-yl)-10,31-dioxa-17-azanonacyclo[24.4.2.0²,¹⁵.0⁵,¹⁴.0⁶,¹¹.0¹⁶,³⁰.0¹⁸,²⁹.0²¹,²⁸.0²⁴,²⁷]dotriaconta-6,16(30),18,20,28-pentaene-5,8-diol

(1s,2r,5s,8r,9r,11s,14r,15s,24s,26s,27s)-14,15,32,32-tetramethyl-23-methylidene-9-(prop-1-en-2-yl)-10,31-dioxa-17-azanonacyclo[24.4.2.0²,¹⁵.0⁵,¹⁴.0⁶,¹¹.0¹⁶,³⁰.0¹⁸,²⁹.0²¹,²⁸.0²⁴,²⁷]dotriaconta-6,16(30),18,20,28-pentaene-5,8-diol

C37H45NO4 (567.334841)


   

18-(acetyloxy)-11-ethyl-6,8,16-trimethoxy-13-methyl-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl benzoate

18-(acetyloxy)-11-ethyl-6,8,16-trimethoxy-13-methyl-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl benzoate

C33H45NO7 (567.3195860000001)


   

6-{[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-16-ethyl-4-hydroxy-7-(2-hydroxyethyl)-5,9,13,15-tetramethyl-1-oxacyclohexadeca-11,13-diene-2,10-dione

6-{[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-16-ethyl-4-hydroxy-7-(2-hydroxyethyl)-5,9,13,15-tetramethyl-1-oxacyclohexadeca-11,13-diene-2,10-dione

C31H53NO8 (567.3770978)


   

(3s,6s,9r,12s)-19-butyl-5,8,11,14,17-pentahydroxy-3,12-diisopropyl-6-methyl-9-(2-methylpropyl)-1-oxa-4,7,10,13,16-pentaazacyclononadeca-4,7,10,13,16-pentaen-2-one

(3s,6s,9r,12s)-19-butyl-5,8,11,14,17-pentahydroxy-3,12-diisopropyl-6-methyl-9-(2-methylpropyl)-1-oxa-4,7,10,13,16-pentaazacyclononadeca-4,7,10,13,16-pentaen-2-one

C28H49N5O7 (567.3631804)


   

2-hydroxy-1-(2-hydroxyethyl)-2,4-dimethyl-5-[(5z,7e,9e,11e)-2,4,14-trihydroxy-9,13,15-trimethyl-17-phenylheptadeca-5,7,9,11-tetraen-1-yl]pyrrol-3-one

2-hydroxy-1-(2-hydroxyethyl)-2,4-dimethyl-5-[(5z,7e,9e,11e)-2,4,14-trihydroxy-9,13,15-trimethyl-17-phenylheptadeca-5,7,9,11-tetraen-1-yl]pyrrol-3-one

C34H49NO6 (567.3559694)


   

19-hexyl-5,8,11,14,17-pentahydroxy-12-isopropyl-3,6-dimethyl-9-(2-methylpropyl)-1-oxa-4,7,10,13,16-pentaazacyclononadeca-4,7,10,13,16-pentaen-2-one

19-hexyl-5,8,11,14,17-pentahydroxy-12-isopropyl-3,6-dimethyl-9-(2-methylpropyl)-1-oxa-4,7,10,13,16-pentaazacyclononadeca-4,7,10,13,16-pentaen-2-one

C28H49N5O7 (567.3631804)


   

2,3,23,23,25,25-hexamethyl-8-(prop-1-en-2-yl)-7,24-dioxa-31-azaoctacyclo[15.14.0.0²,¹⁵.0³,¹².0⁶,¹¹.0¹⁸,³⁰.0²⁰,²⁸.0²²,²⁷]hentriaconta-1(17),10,18,20(28),21,26,29-heptaene-9,12-diol

2,3,23,23,25,25-hexamethyl-8-(prop-1-en-2-yl)-7,24-dioxa-31-azaoctacyclo[15.14.0.0²,¹⁵.0³,¹².0⁶,¹¹.0¹⁸,³⁰.0²⁰,²⁸.0²²,²⁷]hentriaconta-1(17),10,18,20(28),21,26,29-heptaene-9,12-diol

C37H45NO4 (567.334841)


   

(2r,3s,4s,5s,6r)-2-(hydroxymethyl)-6-{[(1s,12s,15r,16s,17s,20s)-1,16,20-trimethyl-16-(4-methylpent-3-en-1-yl)-3-azapentacyclo[10.8.0.0²,¹⁰.0⁴,⁹.0¹⁵,²⁰]icosa-2(10),4,6,8-tetraen-17-yl]oxy}oxane-3,4,5-triol

(2r,3s,4s,5s,6r)-2-(hydroxymethyl)-6-{[(1s,12s,15r,16s,17s,20s)-1,16,20-trimethyl-16-(4-methylpent-3-en-1-yl)-3-azapentacyclo[10.8.0.0²,¹⁰.0⁴,⁹.0¹⁵,²⁰]icosa-2(10),4,6,8-tetraen-17-yl]oxy}oxane-3,4,5-triol

C34H49NO6 (567.3559694)


   

(1s,2r,3r,4s,5r,6s,8s,9s,10r,13s,16s,17r)-4-(acetyloxy)-11-ethyl-6,16-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-8-yl benzoate

(1s,2r,3r,4s,5r,6s,8s,9s,10r,13s,16s,17r)-4-(acetyloxy)-11-ethyl-6,16-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-8-yl benzoate

C33H45NO7 (567.3195860000001)


   

5,8,11,14,17-pentahydroxy-3,12-diisopropyl-6-methyl-9-(2-methylpropyl)-19-(sec-butyl)-1-oxa-4,7,10,13,16-pentaazacyclononadeca-4,7,10,13,16-pentaen-2-one

5,8,11,14,17-pentahydroxy-3,12-diisopropyl-6-methyl-9-(2-methylpropyl)-19-(sec-butyl)-1-oxa-4,7,10,13,16-pentaazacyclononadeca-4,7,10,13,16-pentaen-2-one

C28H49N5O7 (567.3631804)


   

(11z,13z)-6-{[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-16-ethyl-4-hydroxy-7-(2-hydroxyethyl)-5,9,13,15-tetramethyl-1-oxacyclohexadeca-11,13-diene-2,10-dione

(11z,13z)-6-{[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-16-ethyl-4-hydroxy-7-(2-hydroxyethyl)-5,9,13,15-tetramethyl-1-oxacyclohexadeca-11,13-diene-2,10-dione

C31H53NO8 (567.3770978)


   

11-ethyl-8,9-dihydroxy-6,16,18-trimethoxy-13-methyl-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl 3-phenylprop-2-enoate

11-ethyl-8,9-dihydroxy-6,16,18-trimethoxy-13-methyl-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl 3-phenylprop-2-enoate

C33H45NO7 (567.3195860000001)


   

14-o-cinnamoylneoline

NA

C33H45NO7 (567.3195860000001)


{"Ingredient_id": "HBIN001538","Ingredient_name": "14-o-cinnamoylneoline","Alias": "NA","Ingredient_formula": "C33H45NO7","Ingredient_Smile": "C1=CC(=CN=C1)C2=CC3=NC(=NN3C(=N2)N)C4=CC=CO4","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT14681","TCMID_id": "3713","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

2-deacetoxyl-10-acetoxytaxine b

NA

C33H45NO7 (567.3195860000001)


{"Ingredient_id": "HBIN005495","Ingredient_name": "2-deacetoxyl-10-acetoxytaxine b","Alias": "NA","Ingredient_formula": "C33H45NO7","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "26043","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

2-deacetoxyl-9-acetoxytaxine b

NA

C33H45NO7 (567.3195860000001)


{"Ingredient_id": "HBIN005496","Ingredient_name": "2-deacetoxyl-9-acetoxytaxine b","Alias": "NA","Ingredient_formula": "C33H45NO7","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "26044","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

2-deacetyl-10-acetyltaxine b

NA

C33H45NO7 (567.3195860000001)


{"Ingredient_id": "HBIN005500","Ingredient_name": "2-deacetyl-10-acetyltaxine b","Alias": "NA","Ingredient_formula": "C33H45NO7","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "4712","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

2-deacetyl-9-acetoxytaxine b

NA

C33H45NO7 (567.3195860000001)


{"Ingredient_id": "HBIN005502","Ingredient_name": "2-deacetyl-9-acetoxytaxine b","Alias": "NA","Ingredient_formula": "C33H45NO7","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "4710","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

8-o-cinnamoylneoline

NA

C33H45NO7 (567.3195860000001)


{"Ingredient_id": "HBIN013852","Ingredient_name": "8-o-cinnamoylneoline","Alias": "NA","Ingredient_formula": "C33H45NO7","Ingredient_Smile": "CCN1CC2(CCC(C34C2C(C(C31)C5(CC(C6CC4C5C6OC(=O)C=CC7=CC=CC=C7)OC)O)OC)O)COC","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "3712","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

   

(11e,13e)-6-{[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-16-ethyl-4-hydroxy-7-(2-hydroxyethyl)-5,9,13,15-tetramethyl-1-oxacyclohexadeca-11,13-diene-2,10-dione

(11e,13e)-6-{[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-16-ethyl-4-hydroxy-7-(2-hydroxyethyl)-5,9,13,15-tetramethyl-1-oxacyclohexadeca-11,13-diene-2,10-dione

C31H53NO8 (567.3770978)


   

(3s,6s,12s,19s)-19-[(2s)-butan-2-yl]-5,8,11,14,17-pentahydroxy-3,12-diisopropyl-6-methyl-9-(2-methylpropyl)-1-oxa-4,7,10,13,16-pentaazacyclononadeca-4,7,10,13,16-pentaen-2-one

(3s,6s,12s,19s)-19-[(2s)-butan-2-yl]-5,8,11,14,17-pentahydroxy-3,12-diisopropyl-6-methyl-9-(2-methylpropyl)-1-oxa-4,7,10,13,16-pentaazacyclononadeca-4,7,10,13,16-pentaen-2-one

C28H49N5O7 (567.3631804)


   

3-benzyl-5,9,13-trihydroxy-6,8,10,12,14,16-hexamethyl-17-(4-methylhexan-2-yl)-1-oxa-4-azacycloheptadeca-4,6,10,14-tetraen-2-one

3-benzyl-5,9,13-trihydroxy-6,8,10,12,14,16-hexamethyl-17-(4-methylhexan-2-yl)-1-oxa-4-azacycloheptadeca-4,6,10,14-tetraen-2-one

C35H53NO5 (567.3923528)


   

(1r,2r,5s,8r,9s,11r,14r,15r,24r,26r,27r)-14,15,32,32-tetramethyl-23-methylidene-9-(prop-1-en-2-yl)-10,31-dioxa-17-azanonacyclo[24.4.2.0²,¹⁵.0⁵,¹⁴.0⁶,¹¹.0¹⁶,³⁰.0¹⁸,²⁹.0²¹,²⁸.0²⁴,²⁷]dotriaconta-6,16(30),18,20,28-pentaene-5,8-diol

(1r,2r,5s,8r,9s,11r,14r,15r,24r,26r,27r)-14,15,32,32-tetramethyl-23-methylidene-9-(prop-1-en-2-yl)-10,31-dioxa-17-azanonacyclo[24.4.2.0²,¹⁵.0⁵,¹⁴.0⁶,¹¹.0¹⁶,³⁰.0¹⁸,²⁹.0²¹,²⁸.0²⁴,²⁷]dotriaconta-6,16(30),18,20,28-pentaene-5,8-diol

C37H45NO4 (567.334841)


   

(3s,6e,8s,9r,10e,12s,13s,14e,16s,17r)-3-benzyl-5,9,13-trihydroxy-6,8,10,12,14,16-hexamethyl-17-[(2s,4s)-4-methylhexan-2-yl]-1-oxa-4-azacycloheptadeca-4,6,10,14-tetraen-2-one

(3s,6e,8s,9r,10e,12s,13s,14e,16s,17r)-3-benzyl-5,9,13-trihydroxy-6,8,10,12,14,16-hexamethyl-17-[(2s,4s)-4-methylhexan-2-yl]-1-oxa-4-azacycloheptadeca-4,6,10,14-tetraen-2-one

C35H53NO5 (567.3923528)


   

(1s,2r,5s,8r,9r,11s,14r,15s,24s,26r,27s)-14,15,32,32-tetramethyl-23-methylidene-9-(prop-1-en-2-yl)-10,31-dioxa-17-azanonacyclo[24.4.2.0²,¹⁵.0⁵,¹⁴.0⁶,¹¹.0¹⁶,³⁰.0¹⁸,²⁹.0²¹,²⁸.0²⁴,²⁷]dotriaconta-6,16(30),18,20,28-pentaene-5,8-diol

(1s,2r,5s,8r,9r,11s,14r,15s,24s,26r,27s)-14,15,32,32-tetramethyl-23-methylidene-9-(prop-1-en-2-yl)-10,31-dioxa-17-azanonacyclo[24.4.2.0²,¹⁵.0⁵,¹⁴.0⁶,¹¹.0¹⁶,³⁰.0¹⁸,²⁹.0²¹,²⁸.0²⁴,²⁷]dotriaconta-6,16(30),18,20,28-pentaene-5,8-diol

C37H45NO4 (567.334841)


   

2-(hydroxymethyl)-6-{[1,16,20-trimethyl-16-(4-methylpent-3-en-1-yl)-3-azapentacyclo[10.8.0.0²,¹⁰.0⁴,⁹.0¹⁵,²⁰]icosa-2(10),4,6,8-tetraen-17-yl]oxy}oxane-3,4,5-triol

2-(hydroxymethyl)-6-{[1,16,20-trimethyl-16-(4-methylpent-3-en-1-yl)-3-azapentacyclo[10.8.0.0²,¹⁰.0⁴,⁹.0¹⁵,²⁰]icosa-2(10),4,6,8-tetraen-17-yl]oxy}oxane-3,4,5-triol

C34H49NO6 (567.3559694)


   

(2-{[(2r)-3-[(4z,7z,10z,13z,16z,19z)-docosa-4,7,10,13,16,19-hexaenoyloxy]-2-hydroxypropyl phosphonato]oxy}ethyl)trimethylazanium

(2-{[(2r)-3-[(4z,7z,10z,13z,16z,19z)-docosa-4,7,10,13,16,19-hexaenoyloxy]-2-hydroxypropyl phosphonato]oxy}ethyl)trimethylazanium

C30H50NO7P (567.332472)


   

(3r,6s,9r,12r,19r)-19-hexyl-5,8,11,14,17-pentahydroxy-12-isopropyl-3,6-dimethyl-9-(2-methylpropyl)-1-oxa-4,7,10,13,16-pentaazacyclononadeca-4,7,10,13,16-pentaen-2-one

(3r,6s,9r,12r,19r)-19-hexyl-5,8,11,14,17-pentahydroxy-12-isopropyl-3,6-dimethyl-9-(2-methylpropyl)-1-oxa-4,7,10,13,16-pentaazacyclononadeca-4,7,10,13,16-pentaen-2-one

C28H49N5O7 (567.3631804)


   

4-(acetyloxy)-11-ethyl-6,16-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-8-yl benzoate

4-(acetyloxy)-11-ethyl-6,16-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-8-yl benzoate

C33H45NO7 (567.3195860000001)


   

(11e,13e)-6-{[4-(dimethylamino)-3,5-dihydroxy-6-methyloxan-2-yl]oxy}-7,16-diethyl-4-hydroxy-5,9,13,15-tetramethyl-1-oxacyclohexadeca-11,13-diene-2,10-dione

(11e,13e)-6-{[4-(dimethylamino)-3,5-dihydroxy-6-methyloxan-2-yl]oxy}-7,16-diethyl-4-hydroxy-5,9,13,15-tetramethyl-1-oxacyclohexadeca-11,13-diene-2,10-dione

C31H53NO8 (567.3770978)


   

11-ethyl-8,18-dihydroxy-6,16-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl 3-phenylprop-2-enoate

11-ethyl-8,18-dihydroxy-6,16-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl 3-phenylprop-2-enoate

C33H45NO7 (567.3195860000001)


   

(1r,2r,3r,4r,5r,6s,8r,9s,10s,13r,16r,17s,18s)-11-ethyl-8,16-dihydroxy-6,18-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl (2e)-3-phenylprop-2-enoate

(1r,2r,3r,4r,5r,6s,8r,9s,10s,13r,16r,17s,18s)-11-ethyl-8,16-dihydroxy-6,18-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl (2e)-3-phenylprop-2-enoate

C33H45NO7 (567.3195860000001)


   

(1s,2r,3r,4s,5r,6s,8r,9s,10s,13r,16s,17r,18s)-11-ethyl-8,9-dihydroxy-6,16,18-trimethoxy-13-methyl-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl (2z)-3-phenylprop-2-enoate

(1s,2r,3r,4s,5r,6s,8r,9s,10s,13r,16s,17r,18s)-11-ethyl-8,9-dihydroxy-6,16,18-trimethoxy-13-methyl-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl (2z)-3-phenylprop-2-enoate

C33H45NO7 (567.3195860000001)


   

(3s,6s,9r,12s,19s)-19-[(2s)-butan-2-yl]-5,8,11,14,17-pentahydroxy-3,12-diisopropyl-6-methyl-9-(2-methylpropyl)-1-oxa-4,7,10,13,16-pentaazacyclononadeca-4,7,10,13,16-pentaen-2-one

(3s,6s,9r,12s,19s)-19-[(2s)-butan-2-yl]-5,8,11,14,17-pentahydroxy-3,12-diisopropyl-6-methyl-9-(2-methylpropyl)-1-oxa-4,7,10,13,16-pentaazacyclononadeca-4,7,10,13,16-pentaen-2-one

C28H49N5O7 (567.3631804)


   

(14z)-9-{[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-3,10-diethyl-7-hydroxy-2,8,12,16-tetramethyl-4,17-dioxabicyclo[14.1.0]heptadec-14-ene-5,13-dione

(14z)-9-{[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-3,10-diethyl-7-hydroxy-2,8,12,16-tetramethyl-4,17-dioxabicyclo[14.1.0]heptadec-14-ene-5,13-dione

C31H53NO8 (567.3770978)


   

2-hydroxy-1-(2-hydroxyethyl)-2,4-dimethyl-5-(2,4,14-trihydroxy-9,13,15-trimethyl-17-phenylheptadeca-5,7,9,11-tetraen-1-yl)pyrrol-3-one

2-hydroxy-1-(2-hydroxyethyl)-2,4-dimethyl-5-(2,4,14-trihydroxy-9,13,15-trimethyl-17-phenylheptadeca-5,7,9,11-tetraen-1-yl)pyrrol-3-one

C34H49NO6 (567.3559694)


   

(1r,2r,3r,5s,8r,9r,10r)-10-(acetyloxy)-2,9-dihydroxy-8,12,15,15-tetramethyl-4-methylidene-13-oxotricyclo[9.3.1.0³,⁸]pentadec-11-en-5-yl 2-(dimethylamino)-3-phenylpropanoate

(1r,2r,3r,5s,8r,9r,10r)-10-(acetyloxy)-2,9-dihydroxy-8,12,15,15-tetramethyl-4-methylidene-13-oxotricyclo[9.3.1.0³,⁸]pentadec-11-en-5-yl 2-(dimethylamino)-3-phenylpropanoate

C33H45NO7 (567.3195860000001)


   

9-{[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-3,10-diethyl-7-hydroxy-2,8,12,16-tetramethyl-4,17-dioxabicyclo[14.1.0]heptadec-14-ene-5,13-dione

9-{[4-(dimethylamino)-3-hydroxy-6-methyloxan-2-yl]oxy}-3,10-diethyl-7-hydroxy-2,8,12,16-tetramethyl-4,17-dioxabicyclo[14.1.0]heptadec-14-ene-5,13-dione

C31H53NO8 (567.3770978)


   

(1s,2r,3r,4s,5r,6s,8r,9s,10s,13r,16s,17r,18s)-11-ethyl-8,9-dihydroxy-6,16,18-trimethoxy-13-methyl-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl (2e)-3-phenylprop-2-enoate

(1s,2r,3r,4s,5r,6s,8r,9s,10s,13r,16s,17r,18s)-11-ethyl-8,9-dihydroxy-6,16,18-trimethoxy-13-methyl-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl (2e)-3-phenylprop-2-enoate

C33H45NO7 (567.3195860000001)


   

(1r,2r,3r,4r,5r,6s,8r,9s,10s,13r,16s,17s,18s)-11-ethyl-8,18-dihydroxy-6,16-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl (2e)-3-phenylprop-2-enoate

(1r,2r,3r,4r,5r,6s,8r,9s,10s,13r,16s,17s,18s)-11-ethyl-8,18-dihydroxy-6,16-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl (2e)-3-phenylprop-2-enoate

C33H45NO7 (567.3195860000001)


   

(1r,2s,3s,4r,5s,6s,8s,9s,10s,13s,16s,17s,18r)-18-(acetyloxy)-11-ethyl-6,8,16-trimethoxy-13-methyl-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl benzoate

(1r,2s,3s,4r,5s,6s,8s,9s,10s,13s,16s,17s,18r)-18-(acetyloxy)-11-ethyl-6,8,16-trimethoxy-13-methyl-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl benzoate

C33H45NO7 (567.3195860000001)


   

11-ethyl-8,16-dihydroxy-6,18-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl 3-phenylprop-2-enoate

11-ethyl-8,16-dihydroxy-6,18-dimethoxy-13-(methoxymethyl)-11-azahexacyclo[7.7.2.1²,⁵.0¹,¹⁰.0³,⁸.0¹³,¹⁷]nonadecan-4-yl 3-phenylprop-2-enoate

C33H45NO7 (567.3195860000001)