Daunomycinone

CAS
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CAS
21794-55-8
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Catalog Number

ACM21794558

Product Name

Daunomycinone

Structure

CAS

21794-55-8

Category

Heterocyclic Organic Compound

Synonyms

Daunomycin Aglicone

IUPAC Name

(7S,9S)-9-acetyl-6,7,9,11-tetrahydroxy-4-methoxy-8,10-dihydro-7H-tetracene-5,12-dione

Molecular Weight

398.36

Molecular Formula

C21H18O8

Canonical SMILES

CC(=O)[C@]1(C[C@@H](C2=C(C3=C(C(=C2C1)O)C(=O)C4=C(C3=O)C(=CC=C4)OC)O)O)O

InChI

InChI=1S/C21H18O8/c1-8(22)21(28)6-10-13(11(23)7-21)19(26)16-15(18(10)25)17(24)9-4-3-5-12(29-2)14(9)20(16)27/h3-5,11,23,25-26,28H,6-7H2,1-2H3/t11-,21-/m0/s1

InChI Key

YOFDHOWPGULAQF-MQJDWESPSA-N

Boiling Point

677.4 °C at 760 mmHg (Predicted)

Melting Point

208-210 °C

Flash Point

243.4±25.0 °C

Density

1.6±0.1 g/cm3

Appearance

Red Solid

Refractive Index

1.713

MSDS

Download MSDS

COA

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Spec Sheet

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