MetaADEDB 2.0 @ LMMD
Ouabain
(LPMXVESGRSUGHW-HBYQJFLCSA-N)
Structure
SMILES
OC[C@@]12[C@H](O)C[C@@H](C[C@@]2(O)CC[C@@H]2[C@@H]1[C@H](O)C[C@]1([C@]2(O)CC[C@@H]1C1=CC(=O)OC1)C)O[C@@H]1O[C@@H](C)[C@@H]([C@H]([C@H]1O)O)O
Type(s)
Approved
ATC code(s)
C01AC01
Molecular Formula:
C29H44O12
Molecular Weight:
584.652
Log P:
-1.5150
Hydrogen Bond Acceptor:
12
Hydrogen Bond Donor:
8
TPSA:
206.6
CAS Number(s):
630-60-4; 11018-89-6
Synonym(s)
1.
Ouabain
2.
Acocantherin
3.
G-Strophanthin
4.
Acolongifloroside K
5.
G Strophanthin
External Link(s)
MeSHD010042
PubChem Compound439501
BindingDB50286739
ChEBI472805
CHEMBLCHEMBL222863
DrugBankDB01092
DrugCentral2004
IUPHAR/BPS Guide to PHARMACOLOGY4826
KEGGcpd:C01443
dr:D00112
Therapeutic Target DatabaseD0AR3J
ZINC8143614
Adverse Drug Event(s)
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