COMPOUND: C09642
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Entry
C09642 Compound
Name
(-)-Salsolinol;
6,7-Isoquinolinediol, 1,2,3,4-tetrahydro-1-methyl-, (S)-;
Salsolinol
Formula
C10H13NO2
Exact mass
179.0946
Mol weight
179.22
Structure
Mol file
KCF file
DB search
Reaction
R08443
Pathway
map01063
Biosynthesis of alkaloids derived from shikimate pathway
Brite
Phytochemical compounds [BR:
br08003
]
Alkaloids
Alkaloids derived from tyrosine
Isoquinoline alkaloids
C09642 (-)-Salsolinol
BRITE hierarchy
Other DBs
CAS:
27740-96-1
PubChem:
11832
ChEBI:
113
KNApSAcK:
C00001915
NIKKAJI:
J21.391H
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KCF data
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ATOM 13
1 C8y C 27.2705 -17.7038
2 C8y C 27.2764 -16.3048
3 C1y C 28.4830 -18.4090
4 C8x C 26.0698 -18.4033
5 C8x C 26.0698 -15.5996
6 C1x C 28.4947 -15.6053
7 N1x N 29.7011 -17.7155
8 C1a C 28.4654 -19.8023
9 C8y C 24.8515 -17.7038
10 C8y C 24.8515 -16.3048
11 C1x C 29.7070 -16.3107
12 O1a O 23.6449 -18.4033
13 O1a O 23.6449 -15.5996
BOND 14
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 1 #Up
8 4 9 2
9 5 10 2
10 6 11 1
11 9 12 1
12 10 13 1
13 7 11 1
14 9 10 1
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