COMPOUND: C10716
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Entry
C10716 Compound
Name
Maculosidine;
Furo(2,3-b)quinoline, 4,6,8-trimethoxy-
Formula
C14H13NO4
Exact mass
259.0845
Mol weight
259.2573
Structure
Mol file
KCF file
DB search
Brite
Phytochemical compounds [BR:
br08003
]
Alkaloids
Alkaloids derived from tryptophan and anthranilic acid
Quinoline alkaloids
C10716 Maculosidine
BRITE hierarchy
Other DBs
CAS:
522-19-0
PubChem:
12899
ChEBI:
6630
KNApSAcK:
C00002184
3DMET:
B04086
NIKKAJI:
J122.157D
LinkDB
All DBs
KCF data
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ATOM 19
1 N5x N 28.0209 -19.1400
2 C8y C 28.0209 -16.3344
3 C8y C 26.8094 -17.0323
4 C8y C 26.8153 -18.4351
5 C8y C 25.6025 -19.1452
6 C8x C 24.3837 -18.4455
7 C8y C 24.3777 -17.0426
8 C8x C 25.5906 -16.3396
9 C8y C 29.2397 -18.4351
10 C8y C 29.2355 -17.0294
11 C8x C 30.5715 -16.5932
12 C8x C 31.3968 -17.7295
13 O2x O 30.5781 -18.8704
14 O2a O 28.0272 -14.9386
15 C1a C 26.8148 -14.2337
16 O2a O 23.1774 -16.3484
17 C1a C 21.9720 -17.0463
18 O2a O 25.6094 -20.5288
19 C1a C 26.8148 -21.2195
BOND 21
1 9 1 2
2 1 4 1
3 3 2 1
4 2 10 2
5 9 10 1
6 10 11 1
7 11 12 2
8 12 13 1
9 13 9 1
10 3 4 2
11 2 14 1
12 4 5 1
13 14 15 1
14 5 6 2
15 7 16 1
16 6 7 1
17 16 17 1
18 7 8 2
19 5 18 1
20 8 3 1
21 18 19 1
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