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Concept information

Preferred term

basidiosin a  

Type

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

Broader concept

charge

  • 0

formula

  • C36H48N6O7

inchi

  • InChI=1S/C36H48N6O7/c1-6-20(4)30-35(48)39-28(16-22-11-13-24(44)14-12-22)34(47)42-31(21(5)43)36(49)40-29(17-23-18-37-26-10-8-7-9-25(23)26)32(45)38-27(15-19(2)3)33(46)41-30/h7-14,18-21,27-31,37,43-44H,6,15-17H2,1-5H3,(H,38,45)(H,39,48)(H,40,49)(H,41,46)(H,42,47)/t20-,21-,27-,28+,29-,30-,31+/m0/s1

inchikey

  • VINBCMBBIMPHNN-GGZGSIAPSA-N

mass

  • 676.815

monoisotopicmass

  • 676.35845

smiles

  • O=C1N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(N[C@@H](C(N[C@@H]1[C@@H](O)C)=O)CC2=CC=C(O)C=C2)=O)[C@H](CC)C)CC(C)C)CC=3C4=C(C=CC=C4)NC3

subset

  • 2_STAR

synonym EXACT

  • (3S,6S,9S,12R,15R)-3-[(2S)-butan-2-yl]-12-[(1S)-1-hydroxyethyl]-15-[(4-hydroxyphenyl)methyl]-9-(1H-indol-3-ylmethyl)-6-(2-methylpropyl)-1,4,7,10,13-pentazacyclopentadecane-2,5,8,11,14-pentone

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:214013

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