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Structure

Fiduxosin hydrochloride

CAS
208992-74-9
Catalog Number
ACM208992749
Category
Other Products
Molecular Weight
592.11
Molecular Formula
C30H29N5O4S.HCl

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Specification

Synonyms
Fiduxosin hydrochloride, Fiduxosin HCl, 208992-74-9, Fiduxosin hydrochloride (USAN), Fiduxosin hydrochloride [USAN], ABT-980, NCGC00162178-02, AC1L58WW, SureCN1321348, DSSTox_CID_28939, DSSTox_RID_83205, UNII-UYV23L1N89, DSSTox_GSID_49013, MLS002153379, F4303_SIGMA, cid_172306, CHEMBL1256028, CTK8E8988, Tox21_113517, CCG-221829
IUPAC Name
3-[4-[(3aR,9bR)-9-methoxy-3,3a,4,9b-tetrahydro-1H-chromeno[3,4-c]pyrrol-2-yl]butyl]-8-phenyl-1H-pyrazino[1,2]thieno[3,4-b]pyrimidine-2,4-dione;hydrochloride
Canonical SMILES
COC1=CC=CC2=C1C3CN(CC3CO2)CCCCN4C(=O)C5=C(C6=NC(=CN=C6S5)C7=CC=CC=C7)NC4=O.Cl
InChI Key
OFPMGRPQOZABPO-GZJHNZOKSA-N
Boiling Point
764.4ºC at 760 mmHg
Flash Point
416.1ºC
Appearance
White solid
Exact Mass
591.17100
H-Bond Acceptor
8
H-Bond Donor
2
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