MetaADEDB 2.0 @ LMMD
emamectin
(CXEGAUYXQAKHKJ-FYOMLGFFSA-N)
Structure
SMILES
CC[C@@H]([C@H]1O[C@@]2(C=C[C@@H]1C)O[C@@H]1C/C=C(\C)/[C@@H](O[C@H]3C[C@H](OC)[C@H]([C@@H](O3)C)O[C@H]3C[C@@H](OC)[C@@H]([C@H](O3)C)NC)[C@@H](C)/C=C/C=C\3/[C@]4([C@H](C(=O)O[C@H](C2)C1)C=C(C)[C@H]([C@H]4OC3)O)O)C
Molecular Formula:
C49H75NO13
Molecular Weight:
886.119
Log P:
5.9954
Hydrogen Bond Acceptor:
14
Hydrogen Bond Donor:
3
TPSA:
161.86
CAS Number(s):
N/A
Synonym(s)
1.
emamectin
2.
4''-epi-methylamino-4''-deoxyavermectin B1
3.
4''-epiacetylamino-4''-deoxyavermectin B1
4.
4''-epiacetylamino-4''-deoxyavermectin B1, (4''R)-isomer
5.
GWN-1972
6.
MK 243
7.
MK-243
8.
avermectin B1, 4''-(acetylamino)-4''-deoxy-, (4''R)-
External Link(s)
MeSHC443359
PubChem Compound57507888
ZINC253387857
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Fish Diseases25255455CTD
2Parasitic Diseases, Animal25255455CTD
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