COMPOUND: C18014
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Entry
C18014 Compound
Name
3,8'-Biflaviolin;
2,3',4,6',7,8'-Hexahydroxy-1,2'-binaphthalene-1',4',5,8-tetraone
Formula
C20H10O10
Exact mass
410.0274
Mol weight
410.2874
Structure
Mol file
KCF file
DB search
Reaction
R08913
Enzyme
1.14.19.69
Brite
Lipids [BR:
br08002
]
PK Polyketides
PK13 Aromatic polyketides
PK1302 Naphthalenes and naphthoquinones
C18014 3,8'-Biflaviolin
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Other DBs
PubChem:
96024234
ChEBI:
51837
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KCF data
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ATOM 30
1 C2y C 30.9437 -23.5105
2 C2y C 30.9437 -24.9151
3 C5x C 29.7498 -25.6173
4 C8y C 28.4857 -24.9151
5 C8y C 28.4857 -23.5105
6 C5x C 29.7498 -22.8083
7 C8x C 27.2919 -25.6173
8 C8y C 26.0980 -24.9151
9 C8x C 26.0980 -23.5105
10 C8y C 27.2919 -22.8083
11 O5x O 29.7498 -21.9637
12 O5x O 29.7498 -27.0219
13 O1a O 32.1375 -25.8973
14 O1a O 24.9042 -25.6173
15 O1a O 27.2919 -21.4037
16 C8y C 32.1521 -22.3994
17 C8y C 33.3453 -23.0950
18 C8x C 34.5607 -22.4001
19 C8y C 34.5666 -21.0001
20 C8y C 33.3733 -20.3045
21 C8y C 32.1580 -20.9994
22 C5x C 33.3791 -18.9045
23 C2x C 32.1696 -18.1995
24 C2y C 30.9543 -18.8944
25 C5x C 30.9485 -20.2943
26 O1a O 33.3395 -24.4999
27 O1a O 35.7921 -20.2993
28 O5x O 34.6046 -18.2038
29 O1a O 29.7367 -18.1844
30 O5x O 29.7243 -20.9943
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 4 7 1
8 7 8 2
9 8 9 1
10 9 10 2
11 5 10 1
12 6 11 2
13 3 12 2
14 2 13 1
15 8 14 1
16 10 15 1
17 1 16 1
18 16 17 2
19 17 18 1
20 18 19 2
21 19 20 1
22 20 21 2
23 16 21 1
24 20 22 1
25 22 23 1
26 23 24 2
27 24 25 1
28 21 25 1
29 17 26 1
30 19 27 1
31 22 28 2
32 24 29 1
33 25 30 2
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