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Concept information

organooxygen compound > ether > cyclic ether > epoxide > chaetoglobosin f

Preferred term

chaetoglobosin f  

Type

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

charge

  • 0

formula

  • C32H38N2O5

inchi

  • InChI=1S/C32H38N2O5/c1-17-8-7-10-22-29-31(4,39-29)19(3)27-24(15-20-16-33-23-11-6-5-9-21(20)23)34-30(38)32(22,27)26(36)13-12-25(35)28(37)18(2)14-17/h5-7,9-11,14,16-17,19,22,24-25,27,29,33,35H,8,12-13,15H2,1-4H3,(H,34,38)/b10-7+,18-14+/t17-,19-,22-,24-,25-,27-,29-,31+,32+/m0/s1

inchikey

  • KTFGDHPTDQFFRL-USMZZGTESA-N

mass

  • 530.65450

monoisotopicmass

  • 530.27807

smiles

  • C[C@H]1[C@H]2[C@H](Cc3c[nH]c4ccccc34)NC(=O)[C@@]22[C@@H](/C=C/C[C@H](C)/C=C(C)/C(=O)[C@@H](O)CCC2=O)[C@@H]2O[C@]12C

subset

  • 3_STAR

synonym EXACT

  • (1E,4S,5E,8S,11aR,14S,14aR,15S,15aR,16aS,16bR)-8-hydroxy-14-(1H-indol-3-ylmethyl)-4,6,15,15a-tetramethyl-9,10,14,14a,15,15a,16a,16b-octahydro-3H-cyclotrideca[d]oxireno[f]isoindole-7,11,12(4H,8H,13H)-trione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:68732

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