COMPOUND: C15222
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Entry
C15222 Compound
Name
3,6,4'-Trihydroxyflavone;
3,6-Dihydroxy-2-(4-hydroxyphenyl)-4H-1-benzopyran-4-one
Formula
C15H10O5
Exact mass
270.0528
Mol weight
270.2369
Structure
Mol file
KCF file
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Brite
Lipids [BR:
br08002
]
PK Polyketides
PK12 Flavonoids
PK1211 Flavones and Flavonols
C15222 3,6,4'-Trihydroxyflavone
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Other DBs
PubChem:
17396219
ChEBI:
79733
NIKKAJI:
J1.351.762B
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KCF data
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ATOM 20
1 C8y C 24.6488 -19.6793
2 C8y C 24.6488 -21.0787
3 C8y C 25.8608 -21.7784
4 C8y C 27.0730 -21.0787
5 C8y C 27.0730 -19.6793
6 O2x O 25.8608 -18.9795
7 C8x C 23.4367 -18.9795
8 C8x C 22.2244 -19.6793
9 C8y C 22.2244 -21.0787
10 C8x C 23.4367 -21.7784
11 C8y C 28.3037 -18.9684
12 C8x C 29.5084 -19.6640
13 C8x C 30.7203 -18.9640
14 C8y C 30.7203 -17.5642
15 C8x C 29.5156 -16.8689
16 C8x C 28.3036 -17.5687
17 O5x O 25.8607 -23.1990
18 O1a O 31.9374 -16.8614
19 O1a O 28.2942 -21.7840
20 O1a O 20.9904 -21.7918
BOND 22
1 1 2 2
2 2 3 1
3 3 4 1
4 4 5 2
5 5 6 1
6 1 6 1
7 1 7 1
8 7 8 2
9 8 9 1
10 9 10 2
11 2 10 1
12 5 11 1
13 11 12 2
14 12 13 1
15 13 14 2
16 14 15 1
17 15 16 2
18 11 16 1
19 3 17 2
20 14 18 1
21 4 19 1
22 9 20 1
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