| Reaction Details |
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 | Report a problem with these data |
| Target | Acetylcholinesterase |
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| Ligand | BDBM50094480 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_1504215 (CHEMBL3591975) |
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| Ki | 2480±n/a nM |
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| Citation |  Heller, L; Schwarz, S; Obernauer, A; Csuk, R Allobetulin derived seco-oleananedicarboxylates act as inhibitors of acetylcholinesterase. Bioorg Med Chem Lett25:2654-6 (2015) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| Acetylcholinesterase |
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| Name: | Acetylcholinesterase |
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| Synonyms: | ACES_ELEEL | Acetylcholinesterase (AChE) | Acetylcholinesterase (EeAChE) | ache |
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| Type: | Enzyme |
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| Mol. Mass.: | 71812.79 |
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| Organism: | Electrophorus electricus (Electric eel) |
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| Description: | n/a |
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| Residue: | 633 |
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| Sequence: | MKILDALLFPVIFIMFFIHLSIAQTDPELTIMTRLGQVQGTRLPVPDRSHVIAFLGIPFA
EPPLGKMRFKPPEPKKPWNDVFDARDYPSACYQYVDTSYPGFSGTEMWNPNRMMSEDCLY
LNVWVPATPRPHNLTVMVWIYGGGFYSGSSSLDVYDGRYLAHSEKVVVVSMNYRVSAFGF
LALNGSAEAPGNVGLLDQRLALQWVQDNIHFFGGNPKQVTIFGESAGAASVGMHLLSPDS
RPKFTRAILQSGVPNGPWRTVSFDEARRRAIKLGRLVGCPDGNDTDLIDCLRSKQPQDLI
DQEWLVLPFSGLFRFSFVPVIDGVVFPDTPEAMLNSGNFKDTQILLGVNQNEGSYFLIYG
APGFSKDNESLITREDFLQGVKMSVPHANEIGLEAVILQYTDWMDEDNPIKNREAMDDIV
GDHNVVCPLQHFAKMYAQYSILQGQTGTASQGNLGWGNSGSASNSGNSQVSVYLYMFDHR
ASNLVWPEWMGVIHGYEIEFVFGLPLEKRLNYTLEEEKLSRRMMKYWANFARTGNPNINV
DGSIDSRRRWPVFTSTEQKHVGLNTDSLKVHKGLKSQFCALWNRFLPRLLNVTENIDDAE
RQWKAEFHRWSSYMMHWKNQFDHYSKQERCTNL
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| BDBM50094480 |
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| n/a |
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| Name | BDBM50094480 |
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| Synonyms: | CHEMBL3586232 |
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| Type | Small organic molecule |
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| Emp. Form. | C33H50O3 |
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| Mol. Mass. | 494.7483 |
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| SMILES | [H][C@]12OC[C@@]3(CCC1(C)C)CC[C@]1(C)[C@]([H])(CC[C@]4([H])[C@@](C)(CCC(=O)OCC#C)[C@@H](CC[C@@]14C)C(C)=C)[C@@]23[H] |r| |
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| Structure | 
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