| Entry |
|
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| Name |
Crocetin;
8,8'-Diapocarotene-8,8'-dioic acid
|
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| Formula |
C20H24O4
|
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| Exact mass |
328.1675
|
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| Mol weight |
328.4022
|
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| Structure |
|
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| Remark |
|
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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 |
Lipids [BR:br08002]
PR Prenol lipids
PR01 Isoprenoids
PR0104 C20 isoprenoids (diterpenes)
PR010401 Acyclic diterpenoids
C08588 Crocetin
Phytochemical compounds [BR:br08003]
Terpenoids
Carotenoids and apocarotenoids
Apocarotenoids
C08588 Crocetin
Risk category of Japanese OTC drugs [BR:br08312]
Third-class OTC drugs
Inorganic and organic chemicals
Crocetin
C08588 Crocetin
Secondary metabolites in pathway maps [br08011.html]
Biosynthetic pathways and modules of secondary metabolites
C08588
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| Other DBs |
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| LinkDB |
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| KCF data |
ATOM 24
1 C2b C 35.0062 -17.8484
2 C2c C 36.2191 -18.5516
3 C2b C 33.7992 -18.5516
4 C6a C 37.4320 -17.8484
5 C1a C 36.2191 -19.9519
6 C2b C 32.5863 -17.8484
7 O6a O 37.4320 -16.4481
8 O6a O 38.6391 -18.5516
9 C2c C 31.3794 -18.5516
10 C2b C 30.1665 -17.8484
11 C1a C 31.3794 -19.9519
12 C2b C 28.9536 -18.5516
13 C2b C 27.7464 -17.8484
14 C2b C 26.5335 -18.5516
15 C2c C 25.3206 -17.8484
16 C2b C 24.1137 -18.5516
17 C1a C 25.3206 -16.4481
18 C2b C 22.9008 -17.8484
19 C2b C 21.6938 -18.5516
20 C2c C 20.4809 -17.8484
21 C6a C 19.2680 -18.5516
22 C1a C 20.4809 -16.4481
23 O6a O 19.2680 -19.9519
24 O6a O 18.0609 -17.8484
BOND 23
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 2
23 21 24 1
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