Exact Mass: 472.2982

(2S)-2-[(2S)-6-amino-2-[(2S)-2-[(2S)-2-aminopropanamido]-3-methylbutanamido]hexanamido]-5-carbamimidamidopentanoic acid

C20H40N8O5 (472.3122)

Macrocarpal B

1H-Cycloprop[e]azulene, 1,3-benzenedicarboxaldehyde deriv.; 5-[(1S)-1-[(1aR,4R,4aR,7S,7aS,7bR)-Decahydro-4-hydroxy-1,1,4,7-tetramethyl-1H-cycloprop[e]azulen-7-yl]-3-methylbutyl]-2,4,6-trihydroxy-1,3-benzenedicarboxaldehyde

C28H40O6 (472.2825)

Macrocarpal B is a sesquiterpenoid. Macrocarpal B is a natural product found in Eucalyptus sideroxylon, Eucalyptus amplifolia, and other organisms with data available.

MacrocarpalA

Val Val Gln Lys

(2S)-6-amino-2-[(2S)-2-[(2S)-2-[(2S)-2-amino-3-methylbutanamido]-3-methylbutanamido]-4-carbamoylbutanamido]hexanoic acid

C21H40N6O6 (472.3009)

KVVAG

Lys-Val-Val-Ala-Gly

C21H40N6O6 (472.3009)

DG(PGF1alpha/0:0/2:0)

C25H44O8 (472.3036)

Paeonenoide A

C28H40O6 (472.2825)

A natural product found in Paeonia rockii subspeciesrockii.

N-[(1s,2s,8s,8as)-8-hydroxy-7-{(2s)-1-[(2r)-2-(methoxymethyl)-1-pyrrolidinyl]-1-oxo-2-propanyl}-1,4a-dimethyldecahydro-2-naphthalenyl]-5-pyrimidinecarboxamide

C26H40N4O4 (472.3049)

N-[[(2S,3S)-5-[(2S)-1-hydroxypropan-2-yl]-3-methyl-6-oxo-8-[(E)-prop-1-enyl]-3,4-dihydro-2H-pyrido[2,3-b][1,5]oxazocin-2-yl]methyl]-N-methyl-3-piperidin-1-ylpropanamide

C26H40N4O4 (472.3049)

(1aR)-1,1aalpha,1bbeta,4,4abeta,7aalpha,7b,8,9,9a-Decahydro-7balpha-hydroxy-9aalpha-[(1-oxo-2,3-dimethylbutyl)oxy]-3-(acetoxymethyl)-1,1,6,8alpha-tetramethyl-5H-cyclopropa[3,4]benzo[1,2-e]azulene-5-one

(1aR)-1,1aalpha,1bbeta,4,4abeta,7aalpha,7b,8,9,9a-Decahydro-7balpha-hydroxy-9aalpha-[(1-oxo-2,3-dimethylbutyl)oxy]-3-(acetoxymethyl)-1,1,6,8alpha-tetramethyl-5H-cyclopropa[3,4]benzo[1,2-e]azulene-5-one

C28H40O6 (472.2825)

[(1R,2R,6R,10S,11R,13S,15R)-8-(acetyloxymethyl)-1-hydroxy-4,12,12,15-tetramethyl-5-oxo-13-tetracyclo[8.5.0.02,6.011,13]pentadeca-3,8-dienyl] 2,3-dimethylbutanoate

C28H40O6 (472.2825)

Tobramycin(5+)

C18H42N5O9 (472.2982)

(6s)-6-[(1r)-1-[(1r,3as,3bs,5r,5ar,9ar,9bs,11as)-5,5a-dihydroxy-9a,11a-dimethyl-9-oxo-1h,2h,3h,3ah,3bh,4h,5h,6h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]ethyl]-3-(hydroxymethyl)-4-methyl-5,6-dihydropyran-2-one

(6s)-6-[(1r)-1-[(1r,3as,3bs,5r,5ar,9ar,9bs,11as)-5,5a-dihydroxy-9a,11a-dimethyl-9-oxo-1h,2h,3h,3ah,3bh,4h,5h,6h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]ethyl]-3-(hydroxymethyl)-4-methyl-5,6-dihydropyran-2-one

C28H40O6 (472.2825)

{"Ingredient_id": "HBIN004192","Ingredient_name": "24,25-dihydrowithanolide a","Alias": "NA","Ingredient_formula": "C28H40O6","Ingredient_Smile": "CC1CC(OC(=O)C1C)C(C)(C2CCC3C2(CCC4C3C5C(O5)C6(C4(C(=O)C=CC6)C)O)C)O","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5739","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

4,20-dideoxyphorbol 12,13-bis(isobutyrate)

C28H40O6 (472.2825)

{"Ingredient_id": "HBIN009849","Ingredient_name": "4,20-dideoxyphorbol 12,13-bis(isobutyrate)","Alias": "NA","Ingredient_formula": "C28H40O6","Ingredient_Smile": "CC1C(C2(C(C2(C)C)C3C1(C4C=C(C(=O)C4CC(=C3)C)C)O)OC(=O)C(C)C)OC(=O)C(C)C","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "5475","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

4β,7β,20r-trihydroxy-1-oxowitha-2,5-dien-22,26-olide

C28H40O6 (472.2825)

{"Ingredient_id": "HBIN010259","Ingredient_name": "4\u03b2,7\u03b2,20r-trihydroxy-1-oxowitha-2,5-dien-22,26-olide","Alias": "NA","Ingredient_formula": "C28H40O6","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "21818","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

ajugin f

C28H40O6 (472.2825)

{"Ingredient_id": "HBIN014989","Ingredient_name": "ajugin f","Alias": "NA","Ingredient_formula": "C28H40O6","Ingredient_Smile": "CC1=C(C(=O)OC(C1)C(C)C2(CCC3(C2(CCC4C3CC=C5C4(C(=O)CCC5)C)C)O)O)CO","Ingredient_weight": "472.6 g/mol","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "814","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "101010479","DrugBank_id": "NA"}

anticancer withanolide pmv70p691-049

C28H40O6 (472.2825)

{"Ingredient_id": "HBIN016371","Ingredient_name": "anticancer withanolide pmv70p691-049","Alias": "NA","Ingredient_formula": "C28H40O6","Ingredient_Smile": "Not Available","Ingredient_weight": "NA","OB_score": "NA","CAS_id": "NA","SymMap_id": "NA","TCMID_id": "1455","TCMSP_id": "NA","TCM_ID_id": "NA","PubChem_id": "NA","DrugBank_id": "NA"}

5-[(1s)-1-[(2s,4ar,5s,8r)-5-(2-hydroxypropan-2-yl)-2,8-dimethyl-4,4a,5,6,7,8-hexahydro-3h-naphthalen-2-yl]-3-methylbutyl]-2,4,6-trihydroxybenzene-1,3-dicarbaldehyde

C28H40O6 (472.2825)

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

C28H40O6 (472.2825)

(2r,5r)-5-[(4z,8e)-10-(5-hydroxy-2-methoxy-3-methylphenyl)-4,8-dimethyl-6-oxodeca-4,8-dien-1-yl]-2-(2-hydroxypropan-2-yl)-5-methyloxolan-3-one

C28H40O6 (472.2825)

(1s,2s,7s,9r,11s,12s,15s,16r)-15-[(1s)-1-[(2r)-4,5-dimethyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-15-hydroxy-2-(hydroxymethyl)-16-methyl-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadecan-3-one

(1s,2s,4s,5r,10r,11s,14r,15r,18s)-5-hydroxy-15-[(1s)-1-[(1s,2r,4s,6s)-2-hydroxy-1,6-dimethyl-3,7-dioxabicyclo[4.1.0]heptan-4-yl]ethyl]-10,14-dimethyl-3-oxapentacyclo[9.7.0.0²,⁴.0⁵,¹⁰.0¹⁴,¹⁸]octadec-7-en-9-one

(1s,2s,4s,5r,10r,11s,14r,15r,18s)-5-hydroxy-15-[(1s)-1-[(1s,2r,4s,6s)-2-hydroxy-1,6-dimethyl-3,7-dioxabicyclo[4.1.0]heptan-4-yl]ethyl]-10,14-dimethyl-3-oxapentacyclo[9.7.0.0²,⁴.0⁵,¹⁰.0¹⁴,¹⁸]octadec-7-en-9-one

C28H40O6 (472.2825)

3-acetyl-3',4,7'-trihydroxy-3',7'-dimethyl-5,5-bis(3-methylbut-2-en-1-yl)-1',2',3'a,4',6',7'a-hexahydrospiro[cyclohexane-1,5'-inden]-3-ene-2,6-dione

C28H40O6 (472.2825)

3-{[(1ar,4r,4ar,7r,7as,7br)-4-hydroxy-1,1,4,7-tetramethyl-octahydrocyclopropa[e]azulen-7-yl]methyl}-2,4,6-trihydroxy-5-(3-methylbutanoyl)benzaldehyde

C28H40O6 (472.2825)

(1s,2r,6s,7r,9s,10s,13r,14s)-7-hydroxy-13-[(1s)-1-[(2r)-5-(hydroxymethyl)-4-methyl-6-oxo-2,3-dihydropyran-2-yl]ethyl]-2,14-dimethyl-3-oxotetracyclo[7.7.0.0²,⁶.0¹⁰,¹⁴]hexadecane-6-carbaldehyde

(6r)-6-[(1s)-1-[(1s,2s,3s,6s,7r,9r,11s,12s,15r,16s)-3,6-dihydroxy-2,16-dimethyl-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadec-4-en-15-yl]ethyl]-3-(hydroxymethyl)-4-methyl-5,6-dihydropyran-2-one

(6r)-6-[(1s)-1-[(1s,2s,3s,6s,7r,9r,11s,12s,15r,16s)-3,6-dihydroxy-2,16-dimethyl-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadec-4-en-15-yl]ethyl]-3-(hydroxymethyl)-4-methyl-5,6-dihydropyran-2-one

(1e,6z,13e)-3,15-dihydroxy-1-(5-hydroxy-2-methoxy-3-methylphenyl)-3,7,11,15-tetramethylhexadeca-1,6,13-triene-5,12-dione

C28H40O6 (472.2825)

(1s,2r,6s,7r,9r,11s,12s,15r,16s)-6-hydroxy-15-[(1s)-1-[(1s,2r,4r,6s)-2-hydroxy-1,6-dimethyl-3,7-dioxabicyclo[4.1.0]heptan-4-yl]ethyl]-2,16-dimethyl-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadec-4-en-3-one

(1s,2r,6s,7r,9r,11s,12s,15r,16s)-6-hydroxy-15-[(1s)-1-[(1s,2r,4r,6s)-2-hydroxy-1,6-dimethyl-3,7-dioxabicyclo[4.1.0]heptan-4-yl]ethyl]-2,16-dimethyl-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadec-4-en-3-one

3,10-dihydroxy-9-(hydroxymethyl)-6a,6b,9,12a-tetramethyl-2-methylidene-1,3,4,5,6,7,8,8a,10,11,12,12b,13,14b-tetradecahydropicene-4a-carboxylic acid

C29H44O5 (472.3189)

(6r)-6-[(1r)-1-[(1s,3ar,3br,9ar,9bs,11ar)-3a-hydroxy-9a,11a-dimethyl-9-oxo-1h,2h,3h,3bh,4h,6h,7h,8h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]-1-hydroxyethyl]-3-(hydroxymethyl)-4-methyl-5,6-dihydropyran-2-one

C28H40O6 (472.2825)

(1s,2r,6s,7r,9r,11s,12s,16s)-6-hydroxy-15-[(1r)-1-hydroxy-1-[(2r)-6-hydroxy-4,5-dimethyl-3,6-dihydro-2h-pyran-2-yl]ethyl]-2,16-dimethyl-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadec-4-en-3-one

(1s,2r,6s,7r,9r,11s,12s,16s)-6-hydroxy-15-[(1r)-1-hydroxy-1-[(2r)-6-hydroxy-4,5-dimethyl-3,6-dihydro-2h-pyran-2-yl]ethyl]-2,16-dimethyl-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadec-4-en-3-one

8-[(acetyloxy)methyl]-1-hydroxy-4,12,12,15-tetramethyl-5-oxotetracyclo[8.5.0.0²,⁶.0¹¹,¹³]pentadeca-3,8-dien-13-yl 2,3-dimethylbutanoate

C28H40O6 (472.2825)

(6r)-6-[(1s)-1-[(1r,3as,3bs,5r,5ar,9ar,9bs,11as)-5,5a-dihydroxy-9a,11a-dimethyl-9-oxo-1h,2h,3h,3ah,3bh,4h,5h,6h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]ethyl]-3-(hydroxymethyl)-4-methyl-5,6-dihydropyran-2-one

(6r)-6-[(1s)-1-[(1r,3as,3bs,5r,5ar,9ar,9bs,11as)-5,5a-dihydroxy-9a,11a-dimethyl-9-oxo-1h,2h,3h,3ah,3bh,4h,5h,6h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]ethyl]-3-(hydroxymethyl)-4-methyl-5,6-dihydropyran-2-one

C28H40O6 (472.2825)

15-[1-(4,5-dimethyl-6-oxooxan-2-yl)-1-hydroxyethyl]-6-hydroxy-2,16-dimethyl-8-oxapentacyclo[9.7.0.0²,⁷.0⁷,⁹.0¹²,¹⁶]octadec-4-en-3-one

C28H40O6 (472.2825)

(1r,2r,6s,10s,11r,13s,14r,15r)-1-hydroxy-4,8,12,12,15-pentamethyl-14-[(2-methylpropanoyl)oxy]-5-oxotetracyclo[8.5.0.0²,⁶.0¹¹,¹³]pentadeca-3,8-dien-13-yl 2-methylpropanoate

C28H40O6 (472.2825)

(6r)-6-[(1r)-1-[(1r,3as,3bs,5r,5ar,9ar,9bs,11as)-5,5a-dihydroxy-9a,11a-dimethyl-9-oxo-1h,2h,3h,3ah,3bh,4h,5h,6h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]-2-hydroxyethyl]-3,4-dimethyl-5,6-dihydropyran-2-one

(6r)-6-[(1r)-1-[(1r,3as,3bs,5r,5ar,9ar,9bs,11as)-5,5a-dihydroxy-9a,11a-dimethyl-9-oxo-1h,2h,3h,3ah,3bh,4h,5h,6h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl]-2-hydroxyethyl]-3,4-dimethyl-5,6-dihydropyran-2-one

C28H40O6 (472.2825)

6-(1-{5,5a-dihydroxy-9a,11a-dimethyl-9-oxo-1h,2h,3h,3ah,3bh,4h,5h,6h,9bh,10h,11h-cyclopenta[a]phenanthren-1-yl}ethyl)-3-(hydroxymethyl)-4-methyl-5,6-dihydropyran-2-one

C28H40O6 (472.2825)