COMPOUND: C10186
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Entry
C10186 Compound
Name
Sinensetin;
5,6,7,3',4'-Pentamethoxyflavone
Formula
C20H20O7
Exact mass
372.1209
Mol weight
372.3686
Structure
Mol file
KCF file
DB search
Brite
Lipids [BR:
br08002
]
PK Polyketides
PK12 Flavonoids
PK1211 Flavones and Flavonols
C10186 Sinensetin
Phytochemical compounds [BR:
br08003
]
Flavonoids
Flavonoids
Flavones
C10186 Sinensetin
BRITE hierarchy
Other DBs
CAS:
2306-27-6
PubChem:
12372
ChEBI:
9159
LIPIDMAPS:
LMPK12111250
KNApSAcK:
C00013596
3DMET:
B03619
NIKKAJI:
J94.519F
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All DBs
KCF data
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ATOM 27
1 C8y C 25.8420 -30.1200
2 C8y C 24.6361 -30.8248
3 C8y C 25.8479 -28.7219
4 C8y C 27.0479 -30.8305
5 C8y C 23.4186 -30.1200
6 O2a O 24.6361 -32.2229
7 O2x O 27.0595 -28.0285
8 C8x C 24.6361 -28.0228
9 C8x C 28.2595 -30.1315
10 O5x O 27.0421 -32.2287
11 C8y C 23.4186 -28.7219
12 O2a O 22.2070 -30.8248
13 C1a C 23.4245 -32.9220
14 C8y C 28.2654 -28.7276
15 O2a O 22.2070 -28.0228
16 C1a C 20.9894 -30.1200
17 C8y C 29.4829 -28.0402
18 C8x C 29.4829 -26.6421
19 C8x C 30.6888 -28.7452
20 C8y C 30.7005 -25.9430
21 C8x C 31.9063 -28.0519
22 C8y C 31.9121 -26.6537
23 O2a O 30.7062 -24.5391
24 O2a O 33.1296 -25.9547
25 C1a C 31.9237 -23.8517
26 C1a C 34.3412 -26.6596
27 C1a C 21.0001 -28.7200
BOND 29
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 2
5 2 6 1
6 3 7 1
7 3 8 1
8 4 9 1
9 4 10 2
10 5 11 1
11 5 12 1
12 6 13 1
13 7 14 1
14 11 15 1
15 12 16 1
16 14 17 1
17 17 18 1
18 17 19 2
19 18 20 2
20 19 21 1
21 20 22 1
22 20 23 1
23 22 24 1
24 23 25 1
25 24 26 1
26 8 11 2
27 9 14 2
28 21 22 2
29 15 27 1
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