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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 > tetrahydropyranyl adriamycin
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > chalcogen molecular entity > organochalcogen compound > organooxygen compound > polyketide > anthracycline > tetrahydropyranyl adriamycin
... > 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 > tetrahydropyranyl adriamycin

Preferred term

tetrahydropyranyl adriamycin  

Type

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

Broader concept

charge

  • 0

formula

  • C32H37NO12

inchi

  • InChI=1S/C32H37NO12/c1-13-26(36)17(33)9-21(44-13)45-19-11-32(41,20(35)12-34)10-16-22(19)29(39)25-24(28(16)38)27(37)15-7-6-14(18-5-3-4-8-43-18)31(42-2)23(15)30(25)40/h6-7,13,17-19,21,26,34,36,38-39,41H,3-5,8-12,33H2,1-2H3/t13-,17-,18?,19-,21-,26+,32-/m0/s1

inchikey

  • MVVAFVGPLFLDEU-HUPBRQEDSA-N

mass

  • 627.643

monoisotopicmass

  • 627.23158

smiles

  • O([C@H]1C[C@@](O)(CC2=C1C(O)=C3C(=C2O)C(=O)C4=C(C3=O)C(OC)=C(C5OCCCC5)C=C4)C(=O)CO)[C@@H]6O[C@H]([C@@H](O)[C@@H](N)C6)C

subset

  • 2_STAR

synonym EXACT

  • (7S,9S)-7-[(2R,4S,5S,6S)-4-amino-5-hydroxy-6-methyloxan-2-yl]oxy-6,9,11-trihydroxy-9-(2-hydroxyacetyl)-4-methoxy-3-(oxan-2-yl)-8,10-dihydro-7H-tetracene-5,12-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:230657

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