MetaADEDB 2.0 @ LMMD
Okadaic Acid
(QNDVLZJODHBUFM-WFXQOWMNSA-N)
Structure
SMILES
CC1=C[C@]2(O[C@@H](C1)[C@@H](/C=C/[C@H]1CC[C@]3(O1)CC[C@@H]1[C@@H](O3)[C@H](O)C(=C)[C@H](O1)[C@H](C[C@@H]([C@H]1O[C@@]3(CCCCO3)CC[C@H]1C)C)O)C)O[C@@H](CC[C@H]2O)C[C@](C(=O)O)(O)C
Type(s)
Experimental
Molecular Formula:
C44H68O13
Molecular Weight:
805.003
Log P:
5.2136
Hydrogen Bond Acceptor:
13
Hydrogen Bond Donor:
5
TPSA:
182.83
CAS Number(s):
78111-17-8
Synonym(s)
1.
Okadaic Acid
2.
Ocadaic Acid
3.
Acid, Ocadaic
4.
Acid, Okadaic
External Link(s)
MeSHD019319
PubChem Compound446512
BindingDB50110676
50097634
ChEBI44658
CHEMBLCHEMBL280487
DrugBankDB02169
IUPHAR/BPS Guide to PHARMACOLOGY5349
KEGGcpd:C01945
Therapeutic Target DatabaseD01SLG
ZINC85601542
Adverse Drug Event(s)
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