COMPOUND: C14894
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Entry
C14894 Compound
Name
3',6'-Dihydroxy-2',4,4'-trimethoxy-chalcone;
1-(3,6-Dihydroxy-2,4-dimethoxyphenyl)-3-(4-methoxyphenyl)-2-propen-1-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
PK1212 Chalcones and dihydrochalcones
C14894 3',6'-Dihydroxy-2',4,4'-trimethoxy-chalcone
BRITE hierarchy
Other DBs
PubChem:
17395892
ChEBI:
79421
NIKKAJI:
J2.790.397E
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KCF data
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ATOM 24
1 C8y C 15.6800 -16.3800
2 C5a C 16.8700 -17.0800
3 C8y C 14.4200 -17.0100
4 C8y C 15.6800 -14.9800
5 C2b C 18.0600 -16.4500
6 O5a O 16.8700 -18.4800
7 C8y C 13.2300 -16.3100
8 C8x C 14.4900 -14.2800
9 C2b C 19.2500 -17.1500
10 C8y C 13.2300 -14.9100
11 C8y C 20.5100 -16.4500
12 C8x C 20.5100 -15.0500
13 C8x C 21.7000 -17.1500
14 C8x C 21.7700 -14.4200
15 C8x C 22.8900 -16.5200
16 C8y C 22.8900 -15.1200
17 O2a O 24.1500 -14.4200
18 C1a C 25.3400 -15.1200
19 O2a O 14.4200 -18.4100
20 O1a O 16.9400 -14.2800
21 O1a O 11.9700 -17.0100
22 O2a O 12.0400 -14.2100
23 C1a C 13.2300 -19.1100
24 C1a C 12.0400 -12.8100
BOND 25
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 1
5 2 6 2
6 3 7 1
7 4 8 2
8 5 9 2
9 7 10 2
10 9 11 1
11 11 12 2
12 11 13 1
13 12 14 1
14 13 15 2
15 14 16 2
16 8 10 1
17 15 16 1
18 16 17 1
19 17 18 1
20 3 19 1
21 4 20 1
22 7 21 1
23 10 22 1
24 19 23 1
25 22 24 1
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