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Chemistry, part 3

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > oxygen molecular entity > organooxygen compound > polyketide > anthracycline > n-acetyldaunomycin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > polyketide > anthracycline > n-acetyldaunomycin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > heteroorganic entity > organochalcogen compound > organooxygen compound > polyketide > anthracycline > n-acetyldaunomycin

Preferred term

n-acetyldaunomycin  

Type

  • http://www.irandoc.ac.ir/onto/irandoc-meta/Concept

Broader concept

charge

  • 0

formula

  • C29H31NO11

inchi

  • InChI=1S/C29H31NO11/c1-11-24(33)16(30-13(3)32)8-19(40-11)41-18-10-29(38,12(2)31)9-15-21(18)28(37)23-22(26(15)35)25(34)14-6-5-7-17(39-4)20(14)27(23)36/h5-7,11,16,18-19,24,33,35,37-38H,8-10H2,1-4H3,(H,30,32)/t11?,16?,18-,19?,24?,29-/m0/s1

inchikey

  • UCEMIGLIQIYVAH-JEEWRSNPSA-N

mass

  • 569.563

monoisotopicmass

  • 569.18971

smiles

  • O=C1C2=C(O)C3=C(C[C@@](O)(C(=O)C)C[C@@H]3OC4OC(C(O)C(C4)NC(=O)C)C)C(=C2C(=O)C=5C1=C(OC)C=CC5)O

subset

  • 2_STAR

synonym EXACT

  • N-[6-[[(1S,3S)-3-acetyl-3,5,12-trihydroxy-10-methoxy-6,11-dioxo-2,4-dihydro-1H-tetracen-1-yl]oxy]-3-hydroxy-2-methyloxan-4-yl]acetamide

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:215179

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