| Entry |
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| Name |
(3'R,4'R)-3'-Epoxyangeloyloxy-4'-acetoxy-3',4'-dihydroseselin
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| Formula |
C21H22O8
|
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| Exact mass |
402.1315
|
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| Mol weight |
402.3946
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| Structure |
|
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| Brite |
Phytochemical compounds [BR:br08003]
Phenylpropanoids
Coumarins
Coumarins
C09262 (3'R,4'R)-3'-Epoxyangeloyloxy-4'-acetoxy-3',4'-dihydroseselin
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|---|
| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 29
1 C8y C 28.3630 -15.0490
2 C1y C 28.3223 -16.4409
3 C8y C 29.5977 -14.3735
4 C8y C 27.2508 -14.3093
5 C1y C 27.0935 -17.0991
6 O7a O 29.5103 -17.1747
7 C8y C 29.6443 -12.9698
8 O7x O 30.7916 -15.1190
9 O2x O 25.9578 -14.9732
10 C8x C 27.2098 -12.9000
11 C1z C 25.9812 -16.3652
12 O7a O 27.0469 -18.4968
13 C7a C 29.5396 -18.5782
14 C8x C 28.4446 -12.2361
15 C8x C 30.8848 -12.3175
16 C8y C 32.0321 -14.4550
17 C1a C 24.6707 -15.6314
18 C1a C 24.6531 -16.8075
19 C7a C 25.8122 -19.1608
20 C1a C 30.6576 -19.3180
21 O6a O 28.2291 -19.2422
22 C8x C 32.0787 -13.0514
23 O6a O 33.2319 -15.2063
24 C1z C 24.6300 -18.4210
25 O6a O 25.8356 -20.5584
26 C1y C 24.6241 -19.7548
27 O2x O 23.3895 -19.0849
28 C1a C 23.4651 -17.6872
29 C1a C 23.8650 -20.9553
BOND 32
1 1 2 1
2 1 3 1
3 1 4 2
4 2 5 1
5 2 6 1 #Up
6 3 7 2
7 3 8 1
8 4 9 1
9 4 10 1
10 5 11 1
11 5 12 1 #Up
12 6 13 1
13 7 14 1
14 7 15 1
15 8 16 1
16 11 17 1
17 11 18 1
18 12 19 1
19 13 20 1
20 13 21 2
21 15 22 2
22 16 23 2
23 19 24 1
24 19 25 2
25 24 26 1
26 24 27 1
27 24 28 1
28 9 11 1
29 10 14 2
30 16 22 1
31 26 27 1
32 26 29 1
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