| | COMPOUND: C10695 | |
Entry |
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Name |
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Formula |
C21H30O5
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Exact mass |
362.2093
|
Mol weight |
362.46
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Structure |
|
Brite |
Phytochemical compounds [BR:br08003]
Polyketides
Others
Phloroglucinols
C10695 Humulone
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Other DBs |
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LinkDB |
|
KCF data |
ATOM 26
1 C2y C 27.6429 -17.6063
2 C1z C 27.6429 -19.0073
3 C5x C 28.8602 -19.7113
4 C2y C 30.0703 -19.0073
5 C2y C 30.0703 -17.6063
6 C2y C 28.8602 -16.9093
7 C1b C 26.4321 -19.7113
8 C2b C 25.2211 -19.0073
9 C2c C 24.0173 -19.7113
10 C1a C 22.8063 -19.0073
11 C5a C 31.2757 -19.7043
12 C1b C 32.4867 -19.0003
13 C1c C 33.6906 -19.6972
14 C1a C 34.9015 -18.9932
15 O5a O 31.2774 -21.1052
16 O5x O 28.8619 -21.1123
17 C1a C 24.0173 -21.1123
18 C1a C 33.6936 -21.0983
19 O1a O 31.2850 -16.9101
20 O1a O 26.4291 -16.9086
21 C1b C 28.8619 -15.5082
22 C2b C 30.0771 -14.8058
23 C2c C 30.0787 -13.4048
24 C1a C 31.2939 -12.7093
25 C1a C 28.8654 -12.7063
26 O1a O 27.6360 -20.4082
BOND 26
1 12 13 1
2 13 14 1
3 2 7 1 #Up
4 11 15 2
5 1 2 1
6 3 16 2
7 7 8 1
8 9 17 1
9 2 3 1
10 13 18 1
11 8 9 2
12 5 19 1
13 3 4 1
14 1 20 1
15 9 10 1
16 6 21 1
17 4 5 2
18 21 22 1
19 4 11 1
20 22 23 2
21 5 6 1
22 23 24 1
23 11 12 1
24 23 25 1
25 6 1 2
26 2 26 1 #Down
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