| Entry |
|
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| Name |
|
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| Formula |
C26H34O9
|
|---|
| Exact mass |
490.2203
|
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| Mol weight |
490.54
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| Structure |
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| Reaction |
|
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| Pathway |
| map00999 | Biosynthesis of various plant secondary metabolites |
| map01110 | Biosynthesis of secondary metabolites |
|
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| Module |
| M00900 | Crocin biosynthesis, crocetin => crocin |
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| Enzyme |
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| Brite |
Phytochemical compounds [BR:br08003]
Terpenoids
Carotenoids and apocarotenoids
Apocarotenoids
C19867 beta-D-Glucosyl crocetin
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 35
1 C2b C 33.1608 -28.7813
2 C2c C 34.3443 -29.4775
3 C2b C 31.9774 -29.4775
4 C6a C 35.5975 -28.7813
5 C1a C 34.3443 -30.8699
6 C2b C 30.7939 -28.7813
7 O6a O 35.5975 -27.3889
8 O6a O 36.7810 -29.4775
9 C2c C 29.5407 -29.4775
10 C2b C 28.3572 -28.7813
11 C1a C 29.5407 -30.8699
12 C2b C 27.1737 -29.4775
13 C2b C 25.9206 -28.7813
14 C2b C 24.7370 -29.4775
15 C2c C 23.5535 -28.7813
16 C2b C 22.3004 -29.4775
17 C1a C 23.5535 -27.3889
18 C2b C 21.1168 -28.7813
19 C2b C 19.9334 -29.4775
20 C2c C 18.7499 -28.7813
21 C7a C 17.4968 -29.4775
22 C1a C 18.7499 -27.3889
23 O7a O 17.4968 -30.8699
24 O6a O 16.3132 -28.7813
25 C1y C 16.2910 -31.5661
26 O2x O 15.1020 -30.8794
27 C1y C 13.8961 -31.5755
28 C1y C 13.8959 -32.9679
29 C1y C 15.0849 -33.6545
30 C1y C 16.2908 -32.9584
31 O1a O 15.0847 -35.0467
32 C1b C 12.6716 -30.8684
33 O1a O 11.3420 -31.6948
34 O1a O 12.6797 -33.6699
35 O1a O 17.5133 -33.6645
BOND 35
1 1 2 2
2 1 3 1
3 2 4 1
4 2 5 1
5 3 6 2
6 4 7 2
7 4 8 1
8 6 9 1
9 9 10 2
10 9 11 1
11 10 12 1
12 12 13 2
13 13 14 1
14 14 15 2
15 15 16 1
16 15 17 1
17 16 18 2
18 18 19 1
19 19 20 2
20 20 21 1
21 20 22 1
22 21 23 1
23 21 24 2
24 25 23 1 #Up
25 25 26 1
26 26 27 1
27 27 28 1
28 28 29 1
29 29 30 1
30 25 30 1
31 29 31 1 #Up
32 27 32 1 #Up
33 32 33 1
34 28 34 1 #Down
35 30 35 1 #Down
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