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3,5,12-Trihydroxy-10-methoxy-3-(methoxyacetyl)-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 3-amino-2,3,6-trideoxyhexopyranoside--hydrogen chloride (1/1)

HCID 24197836
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Basic informationNames & identifiersRelated reactionsCompound notes
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Basic information

CAS
66678-33-9
Standard SMILES
COCC(=O)[C@]1(O)Cc2c(O)c3c(c(O)c2[C@@H](OC2CC(N)C(O)C(C)O2)C1)C(=O)c1c(OC)cccc1C3=O.Cl
InChIKey
NFAUERLESUWLDV-IBOVKBSISA-N
Molecular formula
C28H32ClNO11
Average molar mass
594.013 g/mol
Monoisotopic mass
593.16638852

Names & identifiers

Preferred name
3,5,12-Trihydroxy-10-methoxy-3-(methoxyacetyl)-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 3-amino-2,3,6-trideoxyhexopyranoside--hydrogen chloride (1/1)
IUPAC
(1S,3S)-3,5,12-Trihydroxy-10-methoxy-3-(methoxyacetyl)-6,11-dioxo-1,2,3,4,6,11-hexahydrotetracen-1-yl 3-amino-2,3,6-trideoxyhexopyranoside--hydrogen chloride (1/1)

Database identifiers

CAS
66678-33-9
PubChem CID
24197836
DTXSID
DTXSID10985253
ChEMBL
CHEMBL2001710

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