| | COMPOUND: C14942 | |
Entry |
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Name |
2-(2,4,5-Trimethoxyphenyl)-5,6,7,8-tetramethoxy-4H-1-benzopyran-4-one
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Formula |
C22H24O9
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Exact mass |
432.142
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Mol weight |
432.4206
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Structure |
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Brite |
Lipids [BR:br08002]
PK Polyketides
PK12 Flavonoids
PK1211 Flavones and Flavonols
C14942 2-(2,4,5-Trimethoxyphenyl)-5,6,7,8-tetramethoxy-4H-1-benzopyran-4-one
Phytochemical compounds [BR:br08003]
Flavonoids
Flavonoids
Flavones
C14942 2-(2,4,5-Trimethoxyphenyl)-5,6,7,8-tetramethoxy-4H-1-benzopyran-4-one
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Other DBs |
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KCF data |
ATOM 31
1 C8y C 20.3428 -16.1534
2 C8y C 20.3428 -17.5516
3 C8y C 21.5536 -18.2507
4 C8x C 22.7647 -17.5516
5 C8y C 22.7647 -16.1534
6 O2x O 21.5536 -15.4543
7 C8y C 19.1319 -15.4543
8 C8y C 17.9208 -16.1534
9 C8y C 17.9208 -17.5516
10 C8y C 19.1319 -18.2507
11 C8y C 23.9942 -15.4433
12 C8x C 25.1978 -16.1381
13 C8y C 26.4086 -15.4389
14 C8y C 26.4086 -14.0406
15 C8x C 25.2050 -13.3458
16 C8y C 23.9941 -14.0450
17 O2a O 27.6250 -13.3381
18 O5x O 21.5536 -19.6488
19 O2a O 19.1319 -14.0562
20 O2a O 16.6913 -15.4433
21 O2a O 16.6913 -18.2618
22 O2a O 19.1319 -19.6488
23 C1a C 20.3596 -13.3473
24 C1a C 15.4876 -17.5669
25 C1a C 17.9378 -20.3384
26 C1a C 16.6916 -14.0561
27 O2a O 27.6098 -16.1326
28 O2a O 22.7960 -13.3536
29 C1a C 22.7958 -11.9693
30 C1a C 28.8600 -14.0505
31 C1a C 27.6089 -17.5668
BOND 33
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 14 17 1
20 3 18 2
21 7 19 1
22 8 20 1
23 9 21 1
24 10 22 1
25 19 23 1
26 21 24 1
27 22 25 1
28 20 26 1
29 13 27 1
30 16 28 1
31 28 29 1
32 17 30 1
33 27 31 1
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