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Chemistry, part 2

Content language

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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > indolocarbazole > 7-oxo-mlr-52
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > indolocarbazole > 7-oxo-mlr-52
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > indolocarbazole > 7-oxo-mlr-52

Preferred term

7-oxo-mlr-52  

Type

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

Broader concept

charge

  • 0

formula

  • C27H21N3O6

inchi

  • InChI=1S/C27H21N3O6/c1-27-23(35-2)21(31)22(32)26(36-27)29-13-9-5-3-7-11(13)15-17-18(25(34)28-24(17)33)16-12-8-4-6-10-14(12)30(27)20(16)19(15)29/h3-10,21-23,26,31-32H,1-2H3,(H,28,33,34)/t21-,22+,23+,26+,27-/m0/s1

inchikey

  • XQEYSLLYHGBNMQ-WEGPUGCWSA-N

mass

  • 483.480

monoisotopicmass

  • 483.14304

smiles

  • O=C1NC(=O)C2=C1C3=C4N([C@]5(O[C@@H](N6C4=C2C7=C6C=CC=C7)[C@H](O)[C@@H]([C@H]5OC)O)C)C8=C3C=CC=C8

subset

  • 2_STAR

synonym EXACT

  • (2S,3R,4S,5R,6R)-4,5-dihydroxy-3-methoxy-2-methyl-29-oxa-1,7,17-triazaoctacyclo[12.12.2.12,6.07,28.08,13.015,19.020,27.021,26]nonacosa-8,10,12,14,19,21,23,25,27-nonaene-16,18-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:210522

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