MetaADEDB 2.0 @ LMMD
bryostatin 1
(MJQUEDHRCUIRLF-TVIXENOKSA-N)
Structure
SMILES
CCC/C=C/C=C/C(=O)O[C@H]1/C(=C/C(=O)OC)/C[C@@H]2O[C@@]1(O)C(C)(C)/C=C/[C@@H]1O[C@@H](C/C(=C/C(=O)OC)/C1)C[C@]1(O)O[C@H](C[C@H](CC(=O)O[C@H](C2)[C@H](O)C)O)C[C@@H](C1(C)C)OC(=O)C
Molecular Formula:
C47H68O17
Molecular Weight:
905.033
Log P:
4.2799
Hydrogen Bond Acceptor:
17
Hydrogen Bond Donor:
4
TPSA:
240.11
CAS Number(s):
83314-01-6
Synonym(s)
1.
bryostatin 1
External Link(s)
MeSHC046785
PubChem Compound5280757
BindingDB50258529
ChEBI88353
CHEMBLCHEMBL449158
ZINC169357315
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Fatigue10741703CTD
2Lymphoma, Non-Hodgkin10741703CTD
3Pain10741703CTD
4leukemia15070760CTD
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