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Diss Factsheets

Reference substances

Reference substances

IUPAC name:
(4S,4aS,5aR,12aS)-9-amino-4,7-bis(dimethylamino)-3,10,12,12a-tetrahydroxy-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide hydrochloride

Inventory

CAS number:
149934-21-4
Synonyms
Names:
Identifier:
IUPAC name
9-amino polycyclic HCl
Identifier:
other: Regulatory process name
2-Naphthacenecarboxamide, 9-amino-4,7-bis(dimethylamino)-1,4,4a,5,5a,6,11,12a-octahydro-3,10,12,12a-tetrahydroxy-1,11-dioxo-, hydrochloride (1:1), (4S,4aS,5aR,12aS)-
Identifier:
other: Molecular formula
C23H28N4O7.ClH
Identifier:
other: SMILES notation
CN(C)C1C2CC3CC4=C(C(=C(C=C4N(C)C)N)O)C(=C3C(=O)C2(C(=C(C1=O)C(=O)N)O)O)O.Cl
(4S,4aS,5aR,12aS)-9-amino-4,7-bis(dimethylamino)-3,10,12,12a-tetrahydroxy-1,11-dioxo-1,4,4a,5,5a,6,11,12a-octahydrotetracene-2-carboxamide hydrochloride (1:1)

Molecular and structural information

Molecular formula:
C23H29ClN4O7
Molecular weight:
509
SMILES notation:
Cl.CN(C)c2cc(N)c(O)c1C(=O)C=4[C@@H](Cc12)C[C@H]3[C@@H](C(O)=C(C(=O)[C@@]3(O)C=4O)C(N)=O)N(C)C
Structural formula:
Chemical structure

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