| Entry |
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| Name |
3-Hydroxy-7,8-dimethoxy-6-isopropoxy-2-naphthoate;
3-Hydroxy-7,8-dimethoxy-6-isopropoxy-2-naphthoic acid
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|---|
| Formula |
C16H18O6
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| Exact mass |
306.1103
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| Mol weight |
306.31
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| Structure |
|
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| Reaction |
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| Pathway |
| map01059 | Biosynthesis of enediyne antibiotics |
| map01110 | Biosynthesis of secondary metabolites |
|
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| Module |
| M00831 | Kedarcidin 2-hydroxynaphthoate moiety biosynthesis, malonyl-CoA => 3,6,8-trihydroxy-2-naphthoate => 3-hydroxy-7,8-dimethoxy-6-isopropoxy-2-naphthoyl-CoA |
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| Brite |
Lipids [BR:br08002]
PK Polyketides
PK13 Aromatic polyketides
PK1302 Naphthalenes and naphthoquinones
C21323 3-Hydroxy-7,8-dimethoxy-6-isopropoxy-2-naphthoate
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 22
1 C8y C 16.2162 -14.3887
2 C8y C 16.2162 -15.7932
3 C8y C 17.4324 -16.4955
4 C8y C 18.6487 -15.7932
5 C8y C 18.6487 -14.3887
6 C8x C 17.4324 -13.6865
7 C8x C 19.8650 -16.4955
8 C8y C 21.0812 -15.7932
9 C8y C 21.0812 -14.3887
10 C8x C 19.8650 -13.6865
11 O1a O 22.2827 -13.6950
12 C6a C 22.2827 -16.4869
13 O6a O 23.4748 -15.7987
14 O6a O 22.2828 -17.8995
15 O2a O 14.9999 -13.6865
16 O2a O 14.9916 -16.5007
17 C1c C 13.7933 -14.3831
18 C1a C 14.9921 -17.8757
19 O2a O 17.4327 -17.8755
20 C1a C 18.6627 -18.5855
21 C1a C 12.5641 -13.6738
22 C1a C 13.7934 -15.7500
BOND 23
1 1 2 2
2 2 3 1
3 3 4 2
4 4 5 1
5 5 6 2
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 9 11 1
13 8 12 1
14 12 13 1
15 12 14 2
16 1 15 1
17 2 16 1
18 15 17 1
19 16 18 1
20 3 19 1
21 19 20 1
22 17 21 1
23 17 22 1
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