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Chemistry, part 2

Content language

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Concept information

organooxygen compound > oxacycle > furofuran > avertoxin d
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > furofuran > avertoxin d
... > 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 > furofuran > avertoxin d
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > furofuran > avertoxin d
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > organic heterobicyclic compound > furofuran > avertoxin d
... > 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 > organic heterobicyclic compound > furofuran > avertoxin d
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > organic heterobicyclic compound > furofuran > avertoxin d

Preferred term

avertoxin d  

Type

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

Broader concept

charge

  • 0

formula

  • C27H36O7

inchi

  • InChI=1S/C27H36O7/c1-8-19-27(7,30)26(6)22(28)18(33-24(26)34-19)14-12-10-9-11-13-17-15(2)21-20(23(29)32-17)25(4,5)16(3)31-21/h9-14,16,18-19,22,24,28,30H,8H2,1-7H3/b10-9+,13-11+,14-12+/t16-,18-,19-,22+,24+,26+,27+/m1/s1

inchikey

  • XEVKZSAFNVBSSK-JXCILBJESA-N

mass

  • 472.578

monoisotopicmass

  • 472.24610

smiles

  • O=C1OC(=C(C)C2=C1C([C@@H](C)O2)(C)C)/C=C/C=C/C=C/[C@H]3O[C@H]4O[C@H](CC)[C@@]([C@]4([C@H]3O)C)(O)C

subset

  • 2_STAR

synonym EXACT

  • (2R)-6-[(1E,3E,5E)-6-[(2R,3R,3aR,4R,5R,6aS)-2-ethyl-3,4-dihydroxy-3,3a-dimethyl-2,4,5,6a-tetrahydrouro[2,3-b]uran-5-yl]hexa-1,3,5-trienyl]-2,3,3,7-tetramethyl-2H-uro[3,2-c]pyran-4-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:205073

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