Cassamedine

Cassamedine

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Catalog Number ACM16408756
CAS Number 16408-75-6
IUPAC Name 17-Methoxy-5,7,19,21-tetraoxa-13-azahexacyclo[10.10.1.02,10.04,8.016,23.018,22]tricosa-1(22),2,4(8),9,12,14,16(23),17-octaen-11-one
Molecular Weight 349.29
Molecular Formula C19H11NO6
Canonical SMILES COC1=C2C(=C3C4=CC5=C(C=C4C(=O)C6=NC=CC1=C36)OCO5)OCO2
InChI InChI=1S/C19H11NO6/c1-22-17-8-2-3-20-15-13(8)14(18-19(17)26-7-25-18)9-4-11-12(24-6-23-11)5-10(9)16(15)21/h2-5H,6-7H2,1H3
InChI Key DQFLZSJFIQYSGC-UHFFFAOYSA-N
Purity 90%+
Storage Store in dry, low temperature, sealed, 2-8 °C.
Complexity 601
Exact Mass 349.05863707
Heavy Atom Count 26
Monoisotopic Mass 349.05863707
Topological Polar Surface Area 76.1Ų

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