MetaADEDB 2.0 @ LMMD
Aclarubicin
(USZYSDMBJDPRIF-SVEJIMAYSA-N)
Structure
SMILES
COC(=O)[C@@H]1c2cc3c(c(c2[C@H](C[C@]1(O)CC)O[C@@H]1O[C@@H](C)[C@H]([C@H](C1)N(C)C)O[C@H]1C[C@H](O)[C@@H]([C@@H](O1)C)O[C@H]1CCC(=O)[C@@H](O1)C)O)C(=O)c1c(C3=O)cccc1O
Type(s)
Investigational
ATC code(s)
L01DB04
Molecular Formula:
C42H53NO15
Molecular Weight:
811.868
Log P:
3.1577
Hydrogen Bond Acceptor:
16
Hydrogen Bond Donor:
4
TPSA:
217.05
CAS Number(s):
57576-44-0
Synonym(s)
1.
Aclarubicin
2.
Aclacinomycin A
3.
Aclacin
4.
Aclaplastin
5.
MA-144A1
6.
NSC-208734
7.
MA 144A1
8.
MA144A1
9.
NSC 208734
10.
NSC208734
External Link(s)
MeSHD015250
PubChem Compound451415
86289437
BindingDB50368351
ChEBI74619
77980
CHEMBLCHEMBL502620
DrugBankDB11617
DrugCentral80
KEGGcpd:C18638
dr:D02756
ZINC85537142
Adverse Drug Event(s)
NameNumber of ReportsReference(s)Data Source
1Necrosis20399885CTD
2Torsades de Pointes1942537CTD
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