Exact Mass: 623.3893938

Exact Mass Matches: 623.3893938

Found 211 metabolites which its exact mass value is equals to given mass value 623.3893938, within given mass tolerance error 0.05 dalton. Try search metabolite list with more accurate mass tolerance error 0.01 dalton.

Hydroxyhomodestruxin B

16-(2-hydroxy-2-methylpropyl)-5,8,9-trimethyl-3,6-bis(sec-butyl)-dodecahydropyrrolo[1,2-d]1-oxa-4,7,10,13,16-pentaazacyclononadecane-1,4,7,10,14,17-hexone

C31H53N5O8 (623.3893938)

Hydroxyhomodestruxin B is found in herbs and spices. Hydroxyhomodestruxin B is a constituent of the leaves of Sinapis alba (white mustard). Constituent of the leaves of Sinapis alba (white mustard). Hydroxyhomodestruxin B is found in herbs and spices.

apicidin

9-(butan-2-yl)-6-[(1-methoxy-1H-indol-3-yl)methyl]-3-(6-oxooctyl)-tetradecahydro-1H-pyrido[1,2-a]1,4,7,10-tetraazacyclododecane-1,4,7,10-tetrone

C34H49N5O6 (623.3682653999999)

D004791 - Enzyme Inhibitors > D056572 - Histone Deacetylase Inhibitors

Apicidin

Apicidin _120249

C34H49N5O6 (623.3682653999999)

D004791 - Enzyme Inhibitors > D056572 - Histone Deacetylase Inhibitors Apicidin (OSI 2040) is a fungal metabolite, acts as a histone deacetylase (HDAC) inhibitor, with antiparasitic activity and a broad spectrum antiproliferative activity[1]. Apicidin (OSI 2040) is a fungal metabolite, acts as a histone deacetylase (HDAC) inhibitor, with antiparasitic activity and a broad spectrum antiproliferative activity[1].

(3S,6S,9S,12R)-3-[(2S)-butan-2-yl]-6-[(1-methoxyindol-3-yl)methyl]-9-(6-oxooctyl)-1,4,7,10-tetrazabicyclo[10.4.0]hexadecane-2,5,8,11-tetrone

NCGC00165733-02!(3S,6S,9S,12R)-3-[(2S)-butan-2-yl]-6-[(1-methoxyindol-3-yl)methyl]-9-(6-oxooctyl)-1,4,7,10-tetrazabicyclo[10.4.0]hexadecane-2,5,8,11-tetrone

C34H49N5O6 (623.3682653999999)

C30H49N5O9_3-(3-sec-Butyl-6-isopropyl-5,8,9-trimethyl-1,4,7,10,14,17-hexaoxoicosahydropyrrolo[1,2-d][1,4,7,10,13,16]oxapentaazacyclononadecin-16-yl)-2-methylpropanoic acid

NCGC00380598-01_C30H49N5O9_3-(3-sec-Butyl-6-isopropyl-5,8,9-trimethyl-1,4,7,10,14,17-hexaoxoicosahydropyrrolo[1,2-d][1,4,7,10,13,16]oxapentaazacyclononadecin-16-yl)-2-methylpropanoic acid

C30H49N5O9 (623.3530104)

His Arg Arg Arg

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

C24H45N15O5 (623.3727919999999)

Lys Lys Trp Tyr

(2S)-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-2,6-diaminohexanamido]hexanamido]-3-(1H-indol-3-yl)propanamido]-3-(4-hydroxyphenyl)propanoic acid

C32H45N7O6 (623.3431149999999)

Lys Lys Tyr Trp

(2S)-2-[(2S)-2-[(2S)-6-amino-2-[(2S)-2,6-diaminohexanamido]hexanamido]-3-(4-hydroxyphenyl)propanamido]-3-(1H-indol-3-yl)propanoic acid

C32H45N7O6 (623.3431149999999)

Lys Trp Lys Tyr

(2S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2,6-diaminohexanamido]-3-(1H-indol-3-yl)propanamido]hexanamido]-3-(4-hydroxyphenyl)propanoic acid

C32H45N7O6 (623.3431149999999)

Lys Trp Tyr Lys

(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2,6-diaminohexanamido]-3-(1H-indol-3-yl)propanamido]-3-(4-hydroxyphenyl)propanamido]hexanoic acid

C32H45N7O6 (623.3431149999999)

Lys Tyr Lys Trp

(2S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2,6-diaminohexanamido]-3-(4-hydroxyphenyl)propanamido]hexanamido]-3-(1H-indol-3-yl)propanoic acid

C32H45N7O6 (623.3431149999999)

Lys Tyr Trp Lys

(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2,6-diaminohexanamido]-3-(4-hydroxyphenyl)propanamido]-3-(1H-indol-3-yl)propanamido]hexanoic acid

C32H45N7O6 (623.3431149999999)

Arg His Arg Arg

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

C24H45N15O5 (623.3727919999999)

Arg Arg His Arg

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

C24H45N15O5 (623.3727919999999)

Arg Arg Arg His

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

C24H45N15O5 (623.3727919999999)

Trp Lys Lys Tyr

(2S)-2-[(2S)-6-amino-2-[(2S)-6-amino-2-[(2S)-2-amino-3-(1H-indol-3-yl)propanamido]hexanamido]hexanamido]-3-(4-hydroxyphenyl)propanoic acid

C32H45N7O6 (623.3431149999999)

Trp Lys Tyr Lys

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

C32H45N7O6 (623.3431149999999)

Trp Tyr Lys Lys

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

C32H45N7O6 (623.3431149999999)

Tyr Lys Lys Trp

(2S)-2-[(2S)-6-amino-2-[(2S)-6-amino-2-[(2S)-2-amino-3-(4-hydroxyphenyl)propanamido]hexanamido]hexanamido]-3-(1H-indol-3-yl)propanoic acid

C32H45N7O6 (623.3431149999999)

Tyr Lys Trp Lys

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

C32H45N7O6 (623.3431149999999)

Tyr Trp Lys Lys

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

C32H45N7O6 (623.3431149999999)

RVNHV

Arg Val Asn His Val

C26H45N11O7 (623.350326)

GRRVH

Gly Arg Arg Val His

C25H45N13O6 (623.3615589999999)

LLIHE

Leu-Leu-Ile-His-Glu

C29H49N7O8 (623.3642434000001)

PS(12:0/12:0)[U]

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

C30H58NO10P (623.3798138)

Dilauroylphosphatidylserine

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

C30H58NO10P (623.3798138)

Hydroxyhomodestruxin B

3,6-bis(butan-2-yl)-16-(2-hydroxy-2-methylpropyl)-5,8,9-trimethyl-icosahydropyrrolo[1,2-d]1-oxa-4,7,10,13,16-pentaazacyclononadecane-1,4,7,10,14,17-hexone

C31H53N5O8 (623.3893938)

PS 24:0

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

C30H58NO10P (623.3798138)

LPS O-25:1;O

1-(2-methoxy-17Z-tetracosenyl)-sn-glycero-3-phosphoserine

C31H62NO9P (623.4161971999999)

PHODiA-PE

1-hexadecanoyl-2-(5-hydroxy-7-carboxy-6E-heptenoyl)-sn-glycero-3-phosphoethanolamine

C29H54NO11P (623.3434304)

PA-PE

1-hexadecanoyl-2-azeloyl-sn-glycero-phosphoethanolamine

C30H58NO10P (623.3798138)

4-(Tetramethyl-1,3,2-dioxaborolan-2-yl)-N,N-bis-[4-(tetramethyl-1,3,2-dioxaborolan-2-yl)phenyl

C36H48B3NO6 (623.3760597999999)

3-(1-Carboxyethyl)cyclo[D-Lac-L-Pro-L-Ile-N-methyl-L-Val-N-methyl-L-Ala-betaAla-]

C30H49N5O9 (623.3530104)

(3S,6S,9S,12R)-6-[(1-methoxyindol-3-yl)methyl]-9-(6-oxooctyl)-3-sec-butyl-1,4,7,10-tetrazabicyclo[10.4.0]hexadecane-2,5,8,11-tetrone

C34H49N5O6 (623.3682653999999)

D004791 - Enzyme Inhibitors > D056572 - Histone Deacetylase Inhibitors

(3S,6S,9S,12R)-3-[(2R)-butan-2-yl]-6-[(1-methoxy-3-indolyl)methyl]-9-(6-oxooctyl)-1,4,7,10-tetrazabicyclo[10.4.0]hexadecane-2,5,8,11-tetrone

C34H49N5O6 (623.3682653999999)

D004791 - Enzyme Inhibitors > D056572 - Histone Deacetylase Inhibitors

1-Palmitoyl-2-(7-hydroxyheptanoyl)-sn-glycero-3-phosphocholine

C31H62NO9P (623.4161971999999)

A 1-palmitoyl-2-acyl-sn-glycero-3-phosphocholine in which the 2-acyl group is specified as 7-hydroxyheptanoyl.

emericellamide E

C32H57N5O7 (623.4257772000001)

An emericellamide derived from N-[(2R,3R)-3-hydroxy-2-methyldodecanoyl]glycyl-L-valyl-L-leucyl-L-alanyl-L-alanine by the formal intramolecular condensation of the alcoholic hydroxy group with the C-terminal carboxylic acid group.

emericellamide F

C32H57N5O7 (623.4257772000001)

An emericellamide derived from N-[(3S,4S)-3-hydroxy-4-methyldodecanoyl]glycyl-L-valyl-L-leucyl-L-alanyl-L-alanine by the formal intramolecular condensation of the alcoholic hydroxy group with the C-terminal carboxylic acid group.

1-cyclohexyl-3-[(3R,9S,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea

C35H53N5O5 (623.4046487999999)

1-cyclohexyl-3-[(3R,9S,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea

C35H53N5O5 (623.4046487999999)

1-cyclohexyl-3-[(3S,9R,10R)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea

C35H53N5O5 (623.4046487999999)

1-cyclohexyl-3-[(3S,9S,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea

C35H53N5O5 (623.4046487999999)

1-cyclohexyl-3-[(3S,9R,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea

C35H53N5O5 (623.4046487999999)

1-cyclohexyl-3-[(3R,9S,10S)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea

C35H53N5O5 (623.4046487999999)

1-cyclohexyl-3-[(3S,9S,10R)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea

C35H53N5O5 (623.4046487999999)

1-cyclohexyl-3-[(3R,9R,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea

C35H53N5O5 (623.4046487999999)

1-cyclohexyl-3-[(3R,9S,10R)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea

C35H53N5O5 (623.4046487999999)

1-cyclohexyl-3-[(3R,9R,10R)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea

C35H53N5O5 (623.4046487999999)

1-cyclohexyl-3-[(3R,9R,10S)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea

C35H53N5O5 (623.4046487999999)

1-cyclohexyl-3-[(3R,9R,10R)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea

C35H53N5O5 (623.4046487999999)

1-cyclohexyl-3-[(3S,9S,10S)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea

C35H53N5O5 (623.4046487999999)

1-cyclohexyl-3-[(3S,9S,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea

C35H53N5O5 (623.4046487999999)

1-cyclohexyl-3-[(3S,9R,10S)-12-[(2R)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea

C35H53N5O5 (623.4046487999999)

1-cyclohexyl-3-[(3S,9R,10S)-12-[(2S)-1-hydroxypropan-2-yl]-3,10-dimethyl-9-[[methyl(pyridin-4-ylmethyl)amino]methyl]-13-oxo-2,8-dioxa-12-azabicyclo[12.4.0]octadeca-1(14),15,17-trien-16-yl]urea

C35H53N5O5 (623.4046487999999)

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

C31H62NO9P (623.4161971999999)

Lnape 26:6/N-2:0

C33H54NO8P (623.3586854)

Lnape 24:6/N-4:0

C33H54NO8P (623.3586854)

Lnape 6:0/N-22:6

C33H54NO8P (623.3586854)

Lnaps 16:0/N-8:0

C30H58NO10P (623.3798138)

Lnaps 3:0/N-21:0

C30H58NO10P (623.3798138)

Lnaps 4:0/N-20:0

C30H58NO10P (623.3798138)

Lnaps 5:0/N-19:0

C30H58NO10P (623.3798138)

Lnaps 2:0/N-22:0

C30H58NO10P (623.3798138)

Lnaps 21:0/N-3:0

C30H58NO10P (623.3798138)

Lnaps 9:0/N-15:0

C30H58NO10P (623.3798138)

Lnape 22:6/N-6:0

C33H54NO8P (623.3586854)

Lnaps 7:0/N-17:0

C30H58NO10P (623.3798138)

Lnape 2:0/N-26:6

C33H54NO8P (623.3586854)

Lnaps 8:0/N-16:0

C30H58NO10P (623.3798138)

Lnaps 20:0/N-4:0

C30H58NO10P (623.3798138)

Lnaps 6:0/N-18:0

C30H58NO10P (623.3798138)

Lnaps 22:0/N-2:0

C30H58NO10P (623.3798138)

Lnape 4:0/N-24:6

C33H54NO8P (623.3586854)

Lnaps 18:0/N-6:0

C30H58NO10P (623.3798138)

Lnaps 17:0/N-7:0

C30H58NO10P (623.3798138)

Lnaps 15:0/N-9:0

C30H58NO10P (623.3798138)

Lnaps 19:0/N-5:0

C30H58NO10P (623.3798138)

Lnaps 11:0/N-13:0

C30H58NO10P (623.3798138)

Lnaps 12:0/N-12:0

C30H58NO10P (623.3798138)

Lnaps 10:0/N-14:0

C30H58NO10P (623.3798138)

Lnaps 14:0/N-10:0

C30H58NO10P (623.3798138)

Lnaps 13:0/N-11:0

C30H58NO10P (623.3798138)

[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-[(8Z,11Z,14Z,17Z,20Z,23Z)-hexacosa-8,11,14,17,20,23-hexaenoxy]propan-2-yl] propanoate

C34H58NO7P (623.3950688)

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

C35H61NO6S (623.4219366)

(4E,8E,12E)-3-hydroxy-2-[[(11Z,14Z)-2-hydroxyicosa-11,14-dienoyl]amino]pentadeca-4,8,12-triene-1-sulfonic acid

C35H61NO6S (623.4219366)

2-[4-(10,13-dimethyl-3-nonanoyloxy-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl)pentanoylamino]ethanesulfonic acid

C35H61NO6S (623.4219366)

(4E,8E,12E)-3-hydroxy-2-[[(10Z,12Z)-2-hydroxyoctadeca-10,12-dienoyl]amino]heptadeca-4,8,12-triene-1-sulfonic acid

C35H61NO6S (623.4219366)

[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-[(6Z,9Z,12Z,15Z,18Z,21Z)-tetracosa-6,9,12,15,18,21-hexaenoxy]propan-2-yl] pentanoate

C34H58NO7P (623.3950688)

[2-acetyloxy-3-[(6Z,9Z,12Z,15Z,18Z,21Z)-tetracosa-6,9,12,15,18,21-hexaenoxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate

C34H58NO7P (623.3950688)

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

C31H62NO9P (623.4161971999999)

2-Amino-3-[hydroxy-(2-tetradecanoyloxy-3-undecoxypropoxy)phosphoryl]oxypropanoic acid

C31H62NO9P (623.4161971999999)

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

C31H62NO9P (623.4161971999999)

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

C31H62NO9P (623.4161971999999)

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

C31H62NO9P (623.4161971999999)

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

C31H62NO9P (623.4161971999999)

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

C34H58NO7P (623.3950688)

[2-butanoyloxy-3-[(4Z,7Z,10Z,13Z,16Z,19Z)-docosa-4,7,10,13,16,19-hexaenoxy]propyl] 2-(trimethylazaniumyl)ethyl phosphate

C34H58NO7P (623.3950688)

Lpc 26:6-SN1

C34H58NO7P (623.3950688)

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

C33H54NO8P (623.3586854)

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

C30H58NO10P (623.3798138)

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

C30H58NO10P (623.3798138)

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

C30H58NO10P (623.3798138)

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

C30H58NO10P (623.3798138)

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

C30H58NO10P (623.3798138)

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

C30H58NO10P (623.3798138)

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

C30H58NO10P (623.3798138)

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

C30H58NO10P (623.3798138)

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

C30H58NO10P (623.3798138)

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

C30H58NO10P (623.3798138)

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

C33H54NO8P (623.3586854)

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

C30H58NO10P (623.3798138)

N-[(E)-1-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3-hydroxydec-4-en-2-yl]heptanamide

C29H53NO13 (623.3516728)

N-[(E)-1-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3-hydroxyundec-4-en-2-yl]hexanamide

C29H53NO13 (623.3516728)

N-[(E)-1-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3-hydroxypentadec-4-en-2-yl]acetamide

C29H53NO13 (623.3516728)

N-[(E)-1-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3-hydroxydodec-4-en-2-yl]pentanamide

C29H53NO13 (623.3516728)

N-[(E)-1-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3-hydroxytetradec-4-en-2-yl]propanamide

C29H53NO13 (623.3516728)

N-[(E)-1-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3-hydroxytridec-4-en-2-yl]butanamide

C29H53NO13 (623.3516728)

N-[(E)-1-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3-hydroxyoct-4-en-2-yl]nonanamide

C29H53NO13 (623.3516728)

N-[(E)-1-[3,4-dihydroxy-6-(hydroxymethyl)-5-[3,4,5-trihydroxy-6-(hydroxymethyl)oxan-2-yl]oxyoxan-2-yl]oxy-3-hydroxynon-4-en-2-yl]octanamide

C29H53NO13 (623.3516728)

(2S)-2-amino-3-[[(2R)-2-decanoyloxy-3-tetradecanoyloxypropoxy]-hydroxyphosphoryl]oxypropanoic acid

C30H58NO10P (623.3798138)

[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-[(E)-dodec-5-enoyl]oxypropan-2-yl] (5E,7E,9E,11E,13E)-hexadeca-5,7,9,11,13-pentaenoate

C33H54NO8P (623.3586854)

[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-[(6E,9E)-dodeca-6,9-dienoyl]oxypropan-2-yl] (7E,9E,11E,13E)-hexadeca-7,9,11,13-tetraenoate

C33H54NO8P (623.3586854)

[1-[2-aminoethoxy(hydroxy)phosphoryl]oxy-3-[(3E,6E,9E)-dodeca-3,6,9-trienoyl]oxypropan-2-yl] (9E,11E,13E)-hexadeca-9,11,13-trienoate

C33H54NO8P (623.3586854)

(2S)-2-amino-3-[hydroxy-[(2R)-2-tridecanoyloxy-3-undecanoyloxypropoxy]phosphoryl]oxypropanoic acid

C30H58NO10P (623.3798138)

(2S)-2-amino-3-[hydroxy-[(2R)-3-tridecanoyloxy-2-undecanoyloxypropoxy]phosphoryl]oxypropanoic acid

C30H58NO10P (623.3798138)

(2S)-2-amino-3-[[(2R)-3-decanoyloxy-2-tetradecanoyloxypropoxy]-hydroxyphosphoryl]oxypropanoic acid

C30H58NO10P (623.3798138)

2-[[(4E,8E)-2-[[(4Z,7Z,10Z,13Z)-hexadeca-4,7,10,13-tetraenoyl]amino]-3-hydroxytrideca-4,8-dienoxy]-hydroxyphosphoryl]oxyethyl-trimethylazanium

C34H60N2O6P+ (623.418877)

2-[hydroxy-[(E)-3-hydroxy-2-[[(3Z,6Z,9Z,12Z,15Z)-octadeca-3,6,9,12,15-pentaenoyl]amino]undec-4-enoxy]phosphoryl]oxyethyl-trimethylazanium

C34H60N2O6P+ (623.418877)

2-[hydroxy-[(E)-3-hydroxy-2-[[(5Z,8Z,11Z,14Z,17Z)-icosa-5,8,11,14,17-pentaenoyl]amino]non-4-enoxy]phosphoryl]oxyethyl-trimethylazanium

C34H60N2O6P+ (623.418877)

phosphatidylethanolamine 28:6

C33H54NO8P (623.3586854)

A 1,2-diacyl-sn-glycero-3-phosphoethanolamine zwitterion in which the acyl groups at C-1 and C-2 contain 28 carbons in total with 6 double bonds.

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

C30H58NO10P (623.3798138)

A 3-sn-phosphatidyl-L-serine in which the two phosphatidyl acyl groups are specified as lauroyl (dodecanoyl).

DGCC 23:5;O2

C33H53NO10 (623.3669278)

DGCC 24:4;O

C34H57NO9 (623.4033112000001)

DGTS 24:4;O2

C34H57NO9 (623.4033112000001)

LPC 26:6

C34H58NO7P (623.3950688)

PC O-18:0/5:1;O2

C31H62NO9P (623.4161971999999)

PC O-23:1;O2

C31H62NO9P (623.4161971999999)

PC 14:0/7:2;O3

C29H54NO11P (623.3434304)

PC 14:0/8:1;O2

C30H58NO10P (623.3798138)

PC 18:0/4:1;O2

C30H58NO10P (623.3798138)

PC 21:2;O3

C29H54NO11P (623.3434304)

PC 22:1;O2

C30H58NO10P (623.3798138)

LNAPE 26:0;O

C31H62NO9P (623.4161971999999)

LNAPE 28:6

C33H54NO8P (623.3586854)

PE O-18:0/7:2;O3

C30H58NO10P (623.3798138)

PE O-18:0/8:1;O2

C31H62NO9P (623.4161971999999)

PE O-25:2;O3

C30H58NO10P (623.3798138)

PE O-26:1;O2

C31H62NO9P (623.4161971999999)

PE 16:0/8:2;O3

C29H54NO11P (623.3434304)

PE 16:0/9:1;O2

C30H58NO10P (623.3798138)

PE 20:0/5:1;O2

C30H58NO10P (623.3798138)

PE 28:6

C33H54NO8P (623.3586854)

LNAPS 23:1;O

C29H54NO11P (623.3434304)

LNAPS 24:0

C30H58NO10P (623.3798138)

LPS 25:0

C31H62NO9P (623.4161971999999)

PS O-14:0/11:0

C31H62NO9P (623.4161971999999)

PS O-16:0/7:2;O2

C29H54NO11P (623.3434304)

PS O-16:0/8:1;O

C30H58NO10P (623.3798138)

PS O-20:0/4:1;O

C30H58NO10P (623.3798138)

PS O-23:2;O2

C29H54NO11P (623.3434304)

PS O-24:1;O

C30H58NO10P (623.3798138)

PS O-25:0

C31H62NO9P (623.4161971999999)

PS P-18:0/5:1;O2

C29H54NO11P (623.3434304)

PS 14:0/9:1;O

C29H54NO11P (623.3434304)

PS 18:0/5:1;O

C29H54NO11P (623.3434304)

PS 23:1;O

C29H54NO11P (623.3434304)

PS 10:0_14:0

C30H58NO10P (623.3798138)

PS 11:0_13:0

C30H58NO10P (623.3798138)

PS 12:0/12:0

C30H58NO10P (623.3798138)

PS 20:0/4:0

C30H58NO10P (623.3798138)

PS 22:0/2:0

C30H58NO10P (623.3798138)

CerP 15:0;O2/20:5

C35H62NO6P (623.4314522)

CerP 15:1;O2/20:4

C35H62NO6P (623.4314522)

CerP 15:2;O2/20:3

C35H62NO6P (623.4314522)

CerP 17:1;O2/18:4

C35H62NO6P (623.4314522)

CerP 17:2;O2/18:3

C35H62NO6P (623.4314522)

CerP 35:5;O2

C35H62NO6P (623.4314522)

ST 25:2;O5;HexNAc

C33H53NO10 (623.3669278)

ST 26:1;O4;HexNAc

C34H57NO9 (623.4033112000001)

ST 28:7;O3;HexNAc

C36H49NO8 (623.3457994)

ST 29:6;O2;HexNAc

C37H53NO7 (623.3821828)

2-{[(1r,2s,4as,8as)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]methyl}-6-[(3-{[(1r,2s,4as,8as)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]methyl}-4-hydroxyphenyl)amino]cyclohexa-2,5-diene-1,4-dione

2-{[(1r,2s,4as,8as)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]methyl}-6-[(3-{[(1r,2s,4as,8as)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]methyl}-4-hydroxyphenyl)amino]cyclohexa-2,5-diene-1,4-dione

C42H57NO3 (623.4338211999999)

3-[1,10-dihydroxy-6-isopropyl-5,8,9-trimethyl-4,7,14,17-tetraoxo-3-(sec-butyl)-3h,6h,9h,12h,13h,16h,19h,20h,21h,21ah-pyrrolo[1,2-d]1-oxa-4,7,10,13,16-pentaazacyclononadecan-16-yl]-2-methylpropanoic acid

3-[1,10-dihydroxy-6-isopropyl-5,8,9-trimethyl-4,7,14,17-tetraoxo-3-(sec-butyl)-3h,6h,9h,12h,13h,16h,19h,20h,21h,21ah-pyrrolo[1,2-d]1-oxa-4,7,10,13,16-pentaazacyclononadecan-16-yl]-2-methylpropanoic acid

C30H49N5O9 (623.3530104)

(2s,6s,8s,9r,12z,14e,16r,25s,27s)-16-ethyl-3,6,8,9-tetrahydroxy-25,27-dimethyl-20,28-dioxo-2-propyl-1-oxa-4-azacyclooctacosa-3,12,14-triene-12-carboxylic acid

C34H57NO9 (623.4033112000001)

apicidin

cyclo(N-O-methyl-L-tryptophanyl-L-isoleucinyl-D-pipecolinyl-L-2-amino-8-oxodecanoyl)

C34H49N5O6 (623.3682653999999)

{"Ingredient_id": "HBIN016406","Ingredient_name": "apicidin","Alias": "cyclo(N-O-methyl-L-tryptophanyl-L-isoleucinyl-D-pipecolinyl-L-2-amino-8-oxodecanoyl)","Ingredient_formula": "C34H49N5O6","Ingredient_Smile": "CCC(C)C1C(=O)N2CCCCC2C(=O)NC(C(=O)NC(C(=O)N1)CC3=CN(C4=CC=CC=C43)OC)CCCCCC(=O)CC","Ingredient_weight": "623.8 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "SMIT14327","TCMID_id": "1475","TCMSP_id": "NA","TCM_ID_id": "10073;10074;10075;10076;10077;10078;10079;10080;12323;12324;12325;12326;12327;12328;12329;12330;12331;12332;12333;12334;12335;12336;16318;16319;16320;16321;16322;16323;16324","PubChem_id": "137795899","DrugBank_id": "NA"}

16-ethyl-3,6,8,9-tetrahydroxy-25,27-dimethyl-20,28-dioxo-2-propyl-1-oxa-4-azacyclooctacosa-3,12,14-triene-12-carboxylic acid

C34H57NO9 (623.4033112000001)

2-{[(1r,2s,4as,8as)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]methyl}-5-[(3-{[(1r,2s,4as,8as)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]methyl}-4-hydroxyphenyl)amino]cyclohexa-2,5-diene-1,4-dione

2-{[(1r,2s,4as,8as)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]methyl}-5-[(3-{[(1r,2s,4as,8as)-1,2,4a,5-tetramethyl-2,3,4,7,8,8a-hexahydronaphthalen-1-yl]methyl}-4-hydroxyphenyl)amino]cyclohexa-2,5-diene-1,4-dione

C42H57NO3 (623.4338211999999)

(15as)-1,4,7-trihydroxy-6-[(1-methoxyindol-3-yl)methyl]-3-(6-oxooctyl)-9-(sec-butyl)-3h,6h,9h,12h,13h,14h,15h,15ah-pyrido[1,2-a]1,4,7,10-tetraazacyclododecan-10-one

C34H49N5O6 (623.3682653999999)

1,4,7-trihydroxy-6-[(1-methoxyindol-3-yl)methyl]-3-(6-oxooctyl)-9-(sec-butyl)-3h,6h,9h,12h,13h,14h,15h,15ah-pyrido[1,2-a]1,4,7,10-tetraazacyclododecan-10-one

C34H49N5O6 (623.3682653999999)

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

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

C36H49NO8 (623.3457994)

(2r)-3-[(3s,6s,9s,16s,21as)-3-[(2s)-butan-2-yl]-1,10-dihydroxy-6-isopropyl-5,8,9-trimethyl-4,7,14,17-tetraoxo-3h,6h,9h,12h,13h,16h,19h,20h,21h,21ah-pyrrolo[1,2-d]1-oxa-4,7,10,13,16-pentaazacyclononadecan-16-yl]-2-methylpropanoic acid

(2r)-3-[(3s,6s,9s,16s,21as)-3-[(2s)-butan-2-yl]-1,10-dihydroxy-6-isopropyl-5,8,9-trimethyl-4,7,14,17-tetraoxo-3h,6h,9h,12h,13h,16h,19h,20h,21h,21ah-pyrrolo[1,2-d]1-oxa-4,7,10,13,16-pentaazacyclononadecan-16-yl]-2-methylpropanoic acid

C30H49N5O9 (623.3530104)

2-{[(1r,2s,4ar,8as)-1,2,4a-trimethyl-5-methylidene-hexahydro-2h-naphthalen-1-yl]methyl}-6-[(3-{[(1r,2s,4ar,8as)-1,2,4a-trimethyl-5-methylidene-hexahydro-2h-naphthalen-1-yl]methyl}-4-hydroxyphenyl)amino]cyclohexa-2,5-diene-1,4-dione

2-{[(1r,2s,4ar,8as)-1,2,4a-trimethyl-5-methylidene-hexahydro-2h-naphthalen-1-yl]methyl}-6-[(3-{[(1r,2s,4ar,8as)-1,2,4a-trimethyl-5-methylidene-hexahydro-2h-naphthalen-1-yl]methyl}-4-hydroxyphenyl)amino]cyclohexa-2,5-diene-1,4-dione

C42H57NO3 (623.4338211999999)

3-[(3s,6s,9s,16r,21as)-3-[(2s)-butan-2-yl]-1,10-dihydroxy-6-isopropyl-5,8,9-trimethyl-4,7,14,17-tetraoxo-3h,6h,9h,12h,13h,16h,19h,20h,21h,21ah-pyrrolo[1,2-d]1-oxa-4,7,10,13,16-pentaazacyclononadecan-16-yl]-2-methylpropanoic acid

3-[(3s,6s,9s,16r,21as)-3-[(2s)-butan-2-yl]-1,10-dihydroxy-6-isopropyl-5,8,9-trimethyl-4,7,14,17-tetraoxo-3h,6h,9h,12h,13h,16h,19h,20h,21h,21ah-pyrrolo[1,2-d]1-oxa-4,7,10,13,16-pentaazacyclononadecan-16-yl]-2-methylpropanoic acid

C30H49N5O9 (623.3530104)

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

C32H57N5O7 (623.4257772000001)

(3s,6s,9s,15ar)-1,4,7-trihydroxy-6-[(1-methoxyindol-3-yl)methyl]-3-(6-oxooctyl)-9-(sec-butyl)-3h,6h,9h,12h,13h,14h,15h,15ah-pyrido[1,2-a]1,4,7,10-tetraazacyclododecan-10-one

C34H49N5O6 (623.3682653999999)

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

C36H49NO8 (623.3457994)

(9s)-9-[(2s)-butan-2-yl]-1,4,7-trihydroxy-6-[(1-methoxyindol-3-yl)methyl]-3-(6-oxooctyl)-3h,6h,9h,12h,13h,14h,15h,15ah-pyrido[1,2-a]1,4,7,10-tetraazacyclododecan-10-one

C34H49N5O6 (623.3682653999999)

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

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

C36H49NO8 (623.3457994)