COMPOUND: C19807
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Entry
C19807 Compound
Name
3',4',5'-O-Trimethyltricetin;
5,7-Dihydroxy-3',4',5'-trimethoxyflavone
Formula
C18H16O7
Exact mass
344.0896
Mol weight
344.31
Structure
Mol file
KCF file
DB search
Reaction
R09678
R09679
Enzyme
2.1.1.169
Brite
Lipids [BR:
br08002
]
PK Polyketides
PK12 Flavonoids
PK1211 Flavones and Flavonols
C19807 3',4',5'-O-Trimethyltricetin
BRITE hierarchy
Other DBs
CAS:
18103-42-9
PubChem:
135626274
ChEBI:
543745
LIPIDMAPS:
LMPK12110880
KNApSAcK:
C00003916
LinkDB
All DBs
KCF data
Show
ATOM 25
1 C8y C 19.0236 -19.4670
2 C8y C 19.0294 -18.0693
3 C8y C 20.2349 -20.1775
4 C8y C 17.8181 -20.1716
5 O2x O 20.2466 -17.3761
6 C8x C 17.8181 -17.3704
7 C8x C 21.4462 -19.4787
8 O5x O 20.2290 -21.5810
9 C8x C 16.6009 -19.4670
10 O1a O 17.8238 -21.5751
11 C8y C 21.4521 -18.0809
12 C8y C 16.6009 -18.0693
13 C8y C 22.6634 -17.3877
14 O1a O 15.3894 -17.3704
15 C8x C 23.8749 -18.0926
16 C8x C 22.6693 -15.9901
17 C8y C 25.1621 -17.3994
18 C8y C 23.8865 -15.2912
19 C8y C 25.0978 -16.0017
20 O2a O 26.2917 -18.1042
21 O2a O 23.8923 -13.8936
22 O2a O 26.3150 -15.3028
23 C1a C 25.1048 -13.2002
24 C1a C 27.5413 -16.0144
25 C1a C 27.5381 -17.4400
BOND 27
1 1 2 2
2 1 3 1
3 1 4 1
4 2 5 1
5 2 6 1
6 3 7 1
7 3 8 2
8 4 9 2
9 4 10 1
10 5 11 1
11 6 12 2
12 11 13 1
13 12 14 1
14 13 15 2
15 13 16 1
16 15 17 1
17 16 18 2
18 17 19 2
19 17 20 1
20 18 21 1
21 19 22 1
22 7 11 2
23 9 12 1
24 18 19 1
25 21 23 1
26 22 24 1
27 20 25 1
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