COMPOUND: C15153
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Entry
C15153 Compound
Name
(-)-Methallenestrilphenol;
(-)-3-(6-Hydroxy-2-naphthyl)-2,2-dimethylpentanoic acid;
(-)-beta-Ethyl-6-hydroxy-alpha,alpha-dimethyl-2-naphthalenepropanoic acid
Formula
C17H20O3
Exact mass
272.1412
Mol weight
272.3389
Structure
Mol file
KCF file
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PubChem:
17396150
ChEBI:
79671
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KCF data
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ATOM 20
1 C8y C 24.6469 -21.1460
2 C8y C 24.6469 -19.7456
3 C8x C 23.4565 -21.8461
4 C8x C 25.9072 -21.8461
5 C8x C 23.4565 -18.9753
6 C8x C 25.9072 -18.9753
7 C8y C 22.2662 -21.1460
8 C8x C 27.1676 -21.1460
9 C8x C 22.2662 -19.7456
10 C8y C 27.1676 -19.7456
11 C1c C 28.3579 -18.9753
12 O1a O 21.0059 -21.8461
13 C1d C 29.6183 -19.7456
14 C1b C 28.3579 -17.5749
15 C1a C 27.1676 -16.8747
16 C6a C 30.8086 -18.9753
17 O6a O 31.9990 -19.7456
18 O6a O 30.8086 -17.5749
19 C1a C 28.9181 -20.7258
20 C1a C 30.3185 -20.7258
BOND 21
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 2
7 4 8 2
8 5 9 2
9 6 10 2
10 7 9 1
11 8 10 1
12 10 11 1
13 7 12 1
14 11 13 1
15 11 14 1 #Down
16 14 15 1
17 13 16 1
18 16 17 1
19 16 18 2
20 13 19 1
21 13 20 1
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