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Chemistry, part 2

Content language

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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > azaphilone > pestafolide a
... > 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 > azaphilone > pestafolide a
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > azaphilone > pestafolide a

Preferred term

pestafolide a  

Type

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

Broader concept

charge

  • 0

formula

  • C15H22O5

inchi

  • InChI=1S/C15H22O5/c1-9-4-3-5-15(20-9)7-10-6-12(16)14(2,18)13(17)11(10)8-19-15/h9,12,16,18H,3-8H2,1-2H3/t9-,12-,14+,15-/m0/s1

inchikey

  • BKSQJYOLLWNPIP-GGZSPTBLSA-N

mass

  • 282.336

monoisotopicmass

  • 282.14672

smiles

  • O=C1C2=C(C[C@]3(O[C@H](CCC3)C)OC2)C[C@@H]([C@]1(O)C)O

subset

  • 2_STAR

synonym EXACT

  • (3S,6S,6'S,7R)-6,7-dihydroxy-6',7-dimethylspiro[1,4,5,6-tetrahydroisochromene-3,2'-oxane]-8-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:200047

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