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Chemistry, part 2

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Concept information

... > organooxygen compound > ether > cyclic ether > epoxide > trichothecene > myrotoxin b
... > organooxygen compound > oxacycle > cyclic ether > epoxide > trichothecene > myrotoxin b
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > cyclic ether > epoxide > trichothecene > myrotoxin b
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > cyclic ether > epoxide > trichothecene > myrotoxin b
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > cyclic ether > epoxide > trichothecene > myrotoxin b
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > sesquiterpenoid > trichothecene > myrotoxin b
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > sesquiterpenoid > trichothecene > myrotoxin b
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > trichothecene > myrotoxin b
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > trichothecene > myrotoxin b
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > trichothecene > myrotoxin b

Preferred term

myrotoxin b  

Type

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

Broader concept

charge

  • 0

formula

  • C29H34O11

inchi

  • InChI=1S/C29H34O11/c1-15-10-20-27(12-18(15)37-16(2)30)13-35-25(33)24-28(40-24)8-9-34-17(23(28)32)6-4-5-7-22(31)39-19-11-21(38-20)29(14-36-29)26(19,27)3/h5-7,10,18-21,23-24,32H,4,8-9,11-14H2,1-3H3/b7-5-,17-6-/t18-,19+,20?,21?,23?,24+,26+,27+,28+,29?/m0/s1

inchikey

  • BDPRKFBFVAVFJK-HHTQSGNKSA-N

mass

  • 558.580

monoisotopicmass

  • 558.21011

smiles

  • O=C1O[C@H]2[C@@]3([C@@]4(C(C=C(C)[C@H](C4)OC(=O)C)OC(C2)C35OC5)COC(=O)[C@@H]6[C@@]7(C(C(=CCC=C1)OCC7)O)O6)C

subset

  • 2_STAR

synonym EXACT

  • [(1R,3S,7R,9S,16S,17R,20Z,23Z)-28-hydroxy-10,16-dimethyl-4,19-dioxospiro[2,5,13,18,25-pentaoxahexacyclo[22.3.1.114,17.01,3.07,12.07,16]nonacosa-10,20,23-triene-15,2'-oxirane]-9-yl] acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:199633

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