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Concept information

Preferred term

penicilindole b  

Type

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

Broader concept

charge

  • 0

formula

  • C28H39NO2

inchi

  • InChI=1S/C28H39NO2/c1-19(2)9-8-14-28-24(17-21-18-29-23-11-7-6-10-22(21)23)27(5,31)16-15-26(28,4)20(3)12-13-25(28)30/h6-7,9-11,18,20,24,29,31H,8,12-17H2,1-5H3/t20-,24-,26+,27-,28-/m1/s1

inchikey

  • KPIWQVIPQWGFNG-VFRRUXMTSA-N

mass

  • 421.625

monoisotopicmass

  • 421.29808

smiles

  • O=C1[C@@]2([C@]([C@H](C)CC1)(CC[C@]([C@H]2CC=3C4=C(C=CC=C4)NC3)(O)C)C)CCC=C(C)C

subset

  • 2_STAR

synonym EXACT

  • (4R,4aS,7R,8S,8aS)-7-hydroxy-8-(1H-indol-3-ylmethyl)-4,4a,7-trimethyl-8a-(4-methylpent-3-enyl)-2,3,4,5,6,8-hexahydronaphthalen-1-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:209235

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