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Concept information

Preferred term

penerpene b  

Type

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

Broader concept

charge

  • 0

formula

  • C27H28N2O3

inchi

  • InChI=1S/C27H28N2O3/c1-25(2)24(31)21-22(32-25)19-18(30)9-10-26(3)20(19)17(28-21)12-13-11-15-14-7-5-6-8-16(14)29-23(15)27(13,26)4/h5-8,13,24,29,31H,9-12H2,1-4H3/t13-,24-,26+,27-/m1/s1

inchikey

  • NDZADURMHLAAAV-KWJMJWPUSA-N

mass

  • 428.532

monoisotopicmass

  • 428.20999

smiles

  • O=C1C2=C3C(=NC4=C2OC(C)(C)[C@@H]4O)C[C@H]5CC6=C([C@@]5([C@@]3(C)CC1)C)NC=7C=CC=CC67

subset

  • 2_STAR

synonym EXACT

  • (1R,2S,13R,18R)-18-hydroxy-1,2,19,19-tetramethyl-20-oxa-4,16-diazaheptacyclo[13.10.1.02,13.03,11.05,10.017,21.022,26]hexacosa-3(11),5,7,9,15(26),16,21-heptaen-23-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:209811

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