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Chemistry, part 2

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > sesquiterpenoid > aflavinine
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > sesquiterpenoid > aflavinine

Preferred term

aflavinine  

Type

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

Broader concept

charge

  • 0

formula

  • C28H39NO

inchi

  • InChI=1S/C28H39NO/c1-17(2)20-13-15-28-24(30)11-10-19(4)27(28,5)14-12-18(3)26(28)25(20)22-16-29-23-9-7-6-8-21(22)23/h6-9,16-19,24,26,29-30H,10-15H2,1-5H3/t18-,19-,24+,26+,27+,28+/m1/s1

inchikey

  • LXZADDNPPHIYMD-QQVIWQHHSA-N

mass

  • 405.626

monoisotopicmass

  • 405.30316

smiles

  • O[C@@H]1[C@]23[C@]([C@H](C)CC1)(CC[C@H]([C@H]2C(=C(C(C)C)CC3)C=4C5=C(C=CC=C5)NC4)C)C

subset

  • 2_STAR

synonym EXACT

  • (1S,4R,4aS,7R,7aS,11aS)-8-(1H-indol-3-yl)-4,4a,7-trimethyl-9-propan-2-yl-1,2,3,4,5,6,7,7a,10,11-decahydrobenzo[i]naphthalen-1-ol

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:199185

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