COMPOUND: C10781
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Entry
C10781 Compound
Name
Rhombifoline;
(1R)-3-(3-Butenyl)-1,2,3,4,5,6-hexahydro-1,5-methano-8H-pyrido[1,2-a][1,4]diazocin-8-one
Formula
C15H20N2O
Exact mass
244.1576
Mol weight
244.33
Structure
Mol file
KCF file
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Brite
Phytochemical compounds [BR:
br08003
]
Alkaloids
Alkaloids derived from lysine
Quinolizidine alkaloids
C10781 Rhombifoline
BRITE hierarchy
Other DBs
CAS:
529-78-2
PubChem:
12964
ChEBI:
8837
KNApSAcK:
C00002234
NIKKAJI:
J102.936C
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KCF data
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ATOM 18
1 C8x C 21.2226 -16.6886
2 C8x C 21.2226 -18.0883
3 C8y C 22.4386 -18.7915
4 C8x C 22.4386 -15.9923
5 C8y C 23.6476 -16.6886
6 N4y N 23.6415 -18.0883
7 C1x C 24.8445 -18.7968
8 C1y C 26.0606 -18.0986
9 C1x C 26.0666 -16.6989
10 C1y C 24.8565 -15.9976
11 C1x C 26.0616 -15.2820
12 N1y N 27.2083 -15.9712
13 C1x C 27.2643 -17.3920
14 O5x O 22.4953 -20.1912
15 C1b C 28.4881 -15.2609
16 C1b C 29.6979 -15.9641
17 C2b C 30.9075 -15.2609
18 C2a C 32.1173 -15.9641
BOND 20
1 7 8 1
2 8 9 1 #Down
3 10 9 1 #Down
4 10 5 1
5 10 11 1
6 8 13 1
7 11 12 1
8 1 2 2
9 2 3 1
10 12 13 1
11 3 6 1
12 3 14 2
13 5 4 2
14 12 15 1
15 4 1 1
16 15 16 1
17 5 6 1
18 16 17 1
19 6 7 1
20 17 18 2
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