COMPOUND: C11324
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Entry
C11324 Compound
Name
6-(3,3-Dimethylallyl)chrysin;
6-(3,3-DMA)chrysin
Formula
C20H18O4
Exact mass
322.1205
Mol weight
322.3545
Structure
Mol file
KCF file
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Brite
Lipids [BR:
br08002
]
PK Polyketides
PK12 Flavonoids
PK1211 Flavones and Flavonols
C11324 6-(3,3-Dimethylallyl)chrysin
BRITE hierarchy
Other DBs
PubChem:
13499
ChEBI:
2161
NIKKAJI:
J1.496.152F
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KCF data
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ATOM 24
1 C8y C 26.2304 -19.1687
2 C8y C 26.2304 -20.5698
3 C8y C 27.4477 -21.2669
4 C8x C 27.4477 -18.4645
5 C8y C 28.6580 -19.1687
6 C8y C 28.6521 -20.5698
7 C8y C 29.8636 -21.2720
8 C8x C 31.0740 -20.5801
9 C8y C 31.0801 -19.1790
10 O2x O 29.8756 -18.4695
11 C8y C 32.2860 -18.4645
12 C8x C 33.5053 -19.1563
13 C8x C 34.7115 -18.4416
14 C8x C 34.6985 -17.0425
15 C8x C 33.4792 -16.3577
16 C8x C 32.2730 -17.0652
17 O5x O 29.9198 -22.6683
18 O1a O 27.4345 -22.6683
19 O1a O 25.0161 -18.4638
20 C1b C 25.0161 -21.2676
21 C2b C 23.8014 -20.5712
22 C2c C 22.5873 -21.2690
23 C1a C 21.3795 -20.5724
24 C1a C 22.5880 -22.6701
BOND 26
1 4 1 2
2 11 12 2
3 12 13 1
4 13 14 2
5 14 15 1
6 15 16 2
7 16 11 1
8 5 6 2
9 7 17 2
10 6 7 1
11 3 18 1
12 7 8 1
13 8 9 2
14 9 10 1
15 10 5 1
16 1 19 1
17 9 11 1
18 2 20 1
19 1 2 1
20 20 21 1
21 2 3 2
22 21 22 2
23 3 6 1
24 22 23 1
25 5 4 1
26 22 24 1
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