Capsella bursa-pastoris (species)

all metabolites associated with this taxon: Capsella bursa-pastoris (species)

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Metabolite Database Reference Structure
Ranupetin

Formula: C16H12O8
Exact Mass: 332.0532
Source ID: CNP0326931.0
  • CAS Registry: 18799-01-4
  • KEGG:
  • LipidMAPS: LMPK12113233
  • BioCYC:
CNP0018459.1

Formula: C27H42O13S2
Exact Mass: 638.2067
Source ID: CNP0018459.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(E)-2-Penten-1-ol

Formula: C5H10O
Exact Mass: 86.0732
Source ID: CNP0239009.0
  • CAS Registry: 1576-96-1
  • KEGG:
  • LipidMAPS: LMFA05000110
  • BioCYC: CPD-13229
Hex-3-en-1-al

Formula: C6H12O
Exact Mass: 100.0888
Source ID: CNP0255718.0
  • CAS Registry: 544-12-7
  • KEGG:
  • LipidMAPS:
  • BioCYC:
D3908

Formula: C28H32O15
Exact Mass: 608.1741
Source ID: CNP0188525.2
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Rivularin D1

Formula: C31H44O5
Exact Mass: 496.3189
Source ID: CNP0433920.1
  • CAS Registry: 81387-84-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Nonanal

Formula: C9H18O
Exact Mass: 142.1358
Source ID: CNP0328165.0
  • CAS Registry: 124-19-6
  • KEGG:
  • LipidMAPS: LMFA06000040
  • BioCYC: CPD-8491
1,4-Dichlorobenzene

Formula: C6H4Cl2
Exact Mass: 145.969
Source ID: CNP0341270.0
  • CAS Registry: 106-46-7
  • KEGG: C07092
  • LipidMAPS:
  • BioCYC: 14-DICHLOROBENZENE
CNP0250677.1

Formula: C15H26O4S
Exact Mass: 302.1552
Source ID: CNP0250677.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Decanal

Formula: C10H20O
Exact Mass: 156.1514
Source ID: CNP0263174.0
  • CAS Registry: 112-31-2
  • KEGG: C12307
  • LipidMAPS: LMFA06000052
  • BioCYC: CPD-8490
Nobiletin

Formula: C21H22O8
Exact Mass: 402.1315
Source ID: CNP0360684.0
  • CAS Registry: 478-01-3
  • KEGG: C10112
  • LipidMAPS: LMPK12111468
  • BioCYC:
[(3S,5S,6S,8S,10S,13S,14S,17S)-17-acetyl-6-hydroxy-10,13-dimethyl-2,3,4,5,6,7,8,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate

Formula: C21H32O6S
Exact Mass: 412.1919
Source ID: CNP0220797.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-Ethylfuran

Formula: C6H8O
Exact Mass: 96.0575
Source ID: CNP0402547.0
  • CAS Registry: 3208-16-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
[(3S,5S,6S,8S,10S,13S,14S,17S)-6-hydroxy-17-[(2S)-2-hydroxy-6-methyl-4-oxoheptan-2-yl]-10,13-dimethyl-2,3,4,5,6,7,8,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-3-yl] hydrogen sulfate

Formula: C27H44O7S
Exact Mass: 512.2808
Source ID: CNP0400259.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Styrene

Formula: C8H8
Exact Mass: 104.0626
Source ID: CNP0111430.0
  • CAS Registry: 100-42-5
  • KEGG: C07083
  • LipidMAPS:
  • BioCYC: CPD-1092
Cyclododecane

Formula: C12H24
Exact Mass: 168.1878
Source ID: CNP0102351.0
  • CAS Registry: 294-62-2
  • KEGG:
  • LipidMAPS:
  • BioCYC:
CNP0359230.1

Formula: C33H54O14S2
Exact Mass: 738.2955
Source ID: CNP0359230.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
CNP0409899.1

Formula: C26H38O12
Exact Mass: 542.2363
Source ID: CNP0409899.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Histamine

Formula: C5H9N3
Exact Mass: 111.0796
Source ID: CNP0591741.0
  • CAS Registry: 51-45-6
  • KEGG: C00388
  • LipidMAPS:
  • BioCYC: HISTAMINE
1,2,3-Butatrien-1-one

Formula: C4H2O
Exact Mass: 66.0106
Source ID: CNP0521230.0
  • CAS Registry: 63766-91-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2,4-Heptadienal

Formula: C7H10O
Exact Mass: 110.0732
Source ID: CNP0276667.0
  • CAS Registry: 5910-85-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
2-Pentenal

Formula: C5H8O
Exact Mass: 84.0575
Source ID: CNP0328747.0
  • CAS Registry: 764-39-6
  • KEGG:
  • LipidMAPS:
  • BioCYC:
(Z)-4-Heptenal

Formula: C7H12O
Exact Mass: 112.0888
Source ID: CNP0265888.0
  • CAS Registry: 6728-31-0
  • KEGG:
  • LipidMAPS:
  • BioCYC:
L-Iditol

Formula: C6H14O6
Exact Mass: 182.079
Source ID: CNP0190948.5
  • CAS Registry: 488-45-9
  • KEGG: C01507
  • LipidMAPS:
  • BioCYC: CPD-369
Sedoheptulose

Formula: C7H14O7
Exact Mass: 210.0739
Source ID: CNP0332839.1
  • CAS Registry: 3019-74-7
  • KEGG: C02076
  • LipidMAPS:
  • BioCYC: SEDOHEPTULOSE
CNP0475911.1

Formula: C35H62O14S
Exact Mass: 738.386
Source ID: CNP0475911.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
Octanal

Formula: C8H16O
Exact Mass: 128.1201
Source ID: CNP0146292.0
  • CAS Registry: 124-13-0
  • KEGG: C01545
  • LipidMAPS: LMFA06000028
  • BioCYC: CPD-371
CNP0527841.0

Formula: C8H8O
Exact Mass: 120.0575
Source ID: CNP0527841.0
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
CNP0424664.1

Formula: C27H44O7S
Exact Mass: 512.2808
Source ID: CNP0424664.1
  • CAS Registry:
  • KEGG:
  • LipidMAPS:
  • BioCYC:
4-Aminobenzenesulfonate

Formula: C6H7NO3S
Exact Mass: 173.0147
Source ID: CNP0300837.0
  • CAS Registry: 121-57-3
  • KEGG: C06335
  • LipidMAPS:
  • BioCYC: CPD-10427