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Concept information

Preferred term

آنسالاکتام B  

Type

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

Broader concept

charge

  • 0

formula

  • C33H39NO6

inchi

  • InChI=1S/C33H39NO6/c1-14(2)9-22-25-20(8)33(40)19(7)12-16(4)10-15(3)11-17(5)26(35)24-23-21(13-18(6)27(24)36)30(38)32(25,34-31(22)39)29(33)28(23)37/h10-14,16,20,22,25,29,36,40H,9H2,1-8H3,(H,34,39)/b15-10-,17-11+,19-12+/t16-,20-,22-,25-,29+,32-,33+/m1/s1

inchikey

  • XYLCRXBLUITNGR-MWVWETOZSA-N

mass

  • 545.676

monoisotopicmass

  • 545.27774

smiles

  • O=C1C(=CC(=C[C@H](C=C([C@]2([C@H]3C(C=4C1=C(O)C(=CC4C(=O)[C@@]53NC(=O)[C@@H]([C@H]5[C@H]2C)CC(C)C)C)=O)O)C)C)C)C

subset

  • 2_STAR

synonym EXACT

  • (1R,4R,5R,6R,7S,8E,10R,11Z,13E,23S)-7,17-dihydroxy-6,8,10,12,14,18-hexamethyl-4-(2-methylpropyl)-2-azapentacyclo[18.3.1.01,5.07,23.016,21]tetracosa-8,11,13,16,18,20-hexaene-3,15,22,24-tetrone

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:202201

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