COMPOUND: C11579
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Entry
C11579 Compound
Name
8-(1,1-Dimethylallyl)-3-methylgalangin;
8-(1,1-DMA)-3-methylgalangin
Formula
C21H20O5
Exact mass
352.1311
Mol weight
352.3805
Structure
Mol file
KCF file
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Brite
Lipids [BR:
br08002
]
PK Polyketides
PK12 Flavonoids
PK1211 Flavones and Flavonols
C11579 8-(1,1-Dimethylallyl)-3-methylgalangin
BRITE hierarchy
Other DBs
PubChem:
13744
ChEBI:
2302
NIKKAJI:
J2.775.208J
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KCF data
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ATOM 26
1 C1d C 25.5621 -17.8029
2 C2b C 24.3585 -17.1080
3 C1a C 25.5282 -16.5034
4 C1a C 26.9527 -16.9474
5 C8y C 25.5675 -19.1907
6 C8y C 26.7701 -19.8936
7 C8y C 26.7644 -21.2878
8 O2x O 27.9843 -19.1965
9 C8y C 27.9726 -21.9907
10 C8y C 25.5675 -21.9850
11 C8y C 24.3593 -19.8936
12 C8y C 29.1927 -19.8995
13 C8y C 29.1868 -21.2995
14 O5x O 27.9669 -23.3792
15 C8x C 24.3593 -21.2878
16 O1a O 25.5675 -23.3733
17 O1a O 23.1511 -19.1965
18 C8y C 30.4068 -19.2024
19 O2a O 30.3893 -22.0023
20 C8x C 31.6151 -19.9111
21 C8x C 30.4068 -17.8082
22 C8x C 32.8292 -19.2140
23 C8x C 31.6208 -17.1110
24 C8x C 32.8292 -17.8139
25 C1a C 31.5967 -21.3138
26 C2a C 23.1593 -17.8000
BOND 28
1 1 4 1
2 1 2 1
3 5 1 1
4 1 3 1
5 6 7 2
6 6 5 1
7 6 8 1
8 7 9 1
9 7 10 1
10 5 11 2
11 8 12 1
12 9 13 1
13 9 14 2
14 10 15 2
15 10 16 1
16 11 17 1
17 12 18 1
18 13 19 1
19 18 20 2
20 18 21 1
21 20 22 1
22 21 23 2
23 22 24 2
24 11 15 1
25 12 13 2
26 23 24 1
27 19 25 1
28 2 26 2
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