COMPOUND: C14997
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Entry
C14997 Compound
Name
6-Hydroxy-4',5,7-trimethoxyflavanone;
2,3-Dihydro-6-hydroxy-2-(4-methoxyphenyl)-5,7-dimethoxy-4H-1-benzopyran-4-one
Formula
C18H18O6
Exact mass
330.1103
Mol weight
330.3319
Structure
Mol file
KCF file
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Brite
Lipids [BR:
br08002
]
PK Polyketides
PK12 Flavonoids
PK1214 Flavanones
C14997 6-Hydroxy-4',5,7-trimethoxyflavanone
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Other DBs
CAS:
6626-61-5
PubChem:
17395994
ChEBI:
79520
NIKKAJI:
J948.997E
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KCF data
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ATOM 24
1 C8y C 20.3225 -15.5084
2 C8y C 20.3225 -16.9052
3 C5x C 21.5321 -17.6036
4 C1x C 22.7420 -16.9052
5 C1y C 22.7420 -15.5084
6 O2x O 21.5321 -14.8099
7 C8x C 19.1128 -14.8099
8 C8y C 17.9029 -15.5084
9 C8y C 17.9029 -16.9052
10 C8y C 19.1128 -17.6036
11 C8y C 23.9703 -14.7988
12 C8x C 25.1727 -15.4932
13 C8x C 26.3823 -14.7944
14 C8y C 26.3823 -13.3975
15 C8x C 25.1799 -12.7035
16 C8x C 23.9702 -13.4019
17 O2a O 27.5977 -12.6958
18 O5x O 21.5321 -19.0004
19 O2a O 16.6745 -14.7988
20 O1a O 16.6745 -17.6147
21 O2a O 19.1128 -19.0004
22 C1a C 17.9198 -19.6893
23 C1a C 16.6748 -13.4130
24 C1a C 28.8413 -13.4133
BOND 26
1 1 2 2
2 2 3 1
3 3 4 1
4 4 5 1
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 14 17 1
20 3 18 2
21 8 19 1
22 9 20 1
23 10 21 1
24 21 22 1
25 19 23 1
26 17 24 1
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