COMPOUND: C09546
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Entry
C09546 Compound
Name
Isococculidine;
Erythrinan, 1,2-didehydro-3,15-dimethoxy-, (3-beta)-
Formula
C18H23NO2
Exact mass
285.1729
Mol weight
285.3807
Structure
Mol file
KCF file
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Brite
Phytochemical compounds [BR:
br08003
]
Alkaloids
Alkaloids derived from tyrosine
Isoquinoline alkaloids
C09546 Isococculidine
BRITE hierarchy
Other DBs
CAS:
60229-91-6
PubChem:
11737
ChEBI:
5999
KNApSAcK:
C00001871
3DMET:
B03068
NIKKAJI:
J71.371F
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KCF data
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ATOM 21
1 C1z C 27.4596 -16.3019
2 C8y C 28.4867 -17.7493
3 N1y N 28.4867 -15.4207
4 C1y C 26.3100 -15.6016
5 C1x C 26.2866 -17.9243
6 C8y C 29.8465 -17.7493
7 C8x C 27.8098 -18.9280
8 C1x C 27.9616 -14.1777
9 C1x C 29.8289 -15.4150
10 C1x C 26.6834 -14.2244
11 C2x C 24.9620 -15.5957
12 C1y C 24.9444 -17.9302
13 C1x C 30.5118 -16.5820
14 C8x C 30.5293 -18.9280
15 C8y C 28.4867 -20.1010
16 C2x C 24.2791 -16.7572
17 O2a O 24.2674 -19.0973
18 C8x C 29.8465 -20.1069
19 O2a O 27.8157 -21.2682
20 C1a C 26.4195 -21.2709
21 C1a C 22.8712 -19.0944
BOND 24
1 1 4 1
2 1 5 1
3 2 6 2
4 2 7 1
5 3 8 1
6 3 9 1
7 4 10 1
8 4 11 1
9 5 12 1
10 6 13 1
11 6 14 1
12 7 15 2
13 11 16 2
14 12 17 1 #Up
15 14 18 2
16 15 19 1
17 8 10 1
18 9 13 1
19 12 16 1
20 15 18 1
21 1 2 1 #Down
22 19 20 1
23 17 21 1
24 1 3 1 #Up
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