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

Preferred term

arimetamycin b  

Type

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

Broader concept

charge

  • 0

formula

  • C27H28O12

inchi

  • InChI=1S/C27H28O12/c1-9-20(30)15(29)8-16(38-9)39-24-19-13(25(34)27(2,35)26(24)37-4)7-12-18(23(19)33)22(32)17-11(21(12)31)5-10(36-3)6-14(17)28/h5-7,9,15-16,20,24,26,28-30,33,35H,8H2,1-4H3/t9-,15-,16-,20-,24+,26-,27+/m0/s1

inchikey

  • IOBWMUZXCVXZEC-NFPJALKISA-N

mass

  • 544.509

monoisotopicmass

  • 544.15808

smiles

  • O=C1C2=C(O)C3=C(C(=O)[C@](O)(C)[C@H]([C@@H]3O[C@@H]4O[C@H]([C@H](O)[C@H](C4)O)C)OC)C=C2C(=O)C=5C1=C(O)C=C(OC)C5

subset

  • 2_STAR

synonym EXACT

  • (2S,3S,4R)-4-[(2S,4S,5R,6S)-4,5-dihydroxy-6-methyloxan-2-yl]oxy-2,5,7-trihydroxy-3,9-dimethoxy-2-methyl-3,4-dihydrotetracene-1,6,11-trione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:211258

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