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Concept information

... > organooxygen compound > ether > cyclic ether > epoxide > trichothecene > satratoxin h 12'-acetate
... > organooxygen compound > oxacycle > cyclic ether > epoxide > trichothecene > satratoxin h 12'-acetate

Preferred term

satratoxin h 12'-acetate  

Type

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

Broader concept

charge

  • 0

formula

  • C31H38O10

inchi

  • InChI=1S/C31H38O10/c1-18-8-11-29-16-36-26(35)14-21-9-12-37-30(19(2)32,27(21)39-20(3)33)10-6-5-7-25(34)41-22-15-24(40-23(29)13-18)31(17-38-31)28(22,29)4/h5-7,10,13-14,19,22-24,27,32H,8-9,11-12,15-17H2,1-4H3/b7-5-,10-6?,21-14?/t19?,22-,23?,24?,27-,28-,29-,30?,31-/m1/s1

inchikey

  • YFKYOBAFGWNPSA-WENWRFNUSA-N

mass

  • 570.635

monoisotopicmass

  • 570.24650

smiles

  • O=C1OC[C@@]23[C@@]4([C@]5(OC5)C(OC2C=C(C)CC3)C[C@H]4OC(=O)C=CC=CC6([C@@H](C(=C1)CCO6)OC(=O)C)C(O)C)C

subset

  • 2_STAR

synonym EXACT

  • [(6R,14R,15S,16R,19Z,27R)-23-(1-hydroxyethyl)-9,15-dimethyl-3,18-dioxospiro[4,12,17,24-tetraoxapentacyclo[21.3.1.113,16.06,11.06,15]octacosa-1,9,19,21-tetraene-14,2'-oxirane]-27-yl] acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:202328

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