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4-(Dimethylamino)-3,5,12,15-tetrahydroxy-13-methoxy-6,12-dimethyl-9,16-dioxo-3,4,5,6,9,11,12,13,14,16-decahydro-2H-2,6-epoxytetraceno[1,2-b]oxocin-14-yl 6-deoxy-3-C-methyl-2-O-methylhexopyranoside

HCID 192525
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

CAS
151233-06-6
Standard SMILES
COC1C(OC2OC(C)C(O)C(C)(O)C2OC)c2c(cc3c(c2O)C(=O)c2c(ccc4c2OC2OC4(C)C(O)C(N(C)C)C2O)C3=O)CC1(C)O
InChIKey
BZFHXAJTVQBODO-UHFFFAOYSA-N
Molecular formula
C36H45NO14
Average molar mass
715.749 g/mol
Monoisotopic mass
715.28400512

Names & identifiers

Preferred name
4-(Dimethylamino)-3,5,12,15-tetrahydroxy-13-methoxy-6,12-dimethyl-9,16-dioxo-3,4,5,6,9,11,12,13,14,16-decahydro-2H-2,6-epoxytetraceno[1,2-b]oxocin-14-yl 6-deoxy-3-C-methyl-2-O-methylhexopyranoside
IUPAC
4-(Dimethylamino)-3,5,12,15-tetrahydroxy-13-methoxy-6,12-dimethyl-9,16-dioxo-3,4,5,6,9,11,12,13,14,16-decahydro-2H-2,6-epoxytetraceno[1,2-b]oxocin-14-yl 6-deoxy-3-C-methyl-2-O-methylhexopyranoside
English name
respinomycin C
Molecular formula
C36H45NO14
Molecular weight
715.74

Names & synonyms

respinomycin C2,6-Epoxy-2H-naphthaceno[1,2-b]oxocin-9,16-dione, 14-[(6-deoxy-3-C-methyl-2-O-methyl-α-D-mannopyranosyl)oxy]-4-(dimethylamino)-3,4,5,6,11,12,13,14-octahydro-3,5,12,15-tetrahydroxy-13-methoxy-6,12-dimethyl-, (2S,3R,4R,5R,6S,12S,13S,14S)-rel-(+)- (9CI)

Database identifiers

CAS
151233-06-6
PubChem CID
192525
DTXSID
DTXSID90934209
Nikkaji
J549.647K

Properties

Physicochemical properties

Boiling point
901.8 · 901.8±65.0 °C(Predicted)
Density
1.52 · 1.52±0.1 g/cm3(Predicted)
pka
6.44 · 6.44±0.70(Predicted)

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Compound notes

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