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Chemistry, part 2

Content language

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Concept information

... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > diterpenoid > pestalpolyol h
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > diterpenoid > pestalpolyol h

Preferred term

pestalpolyol h  

Type

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

Broader concept

charge

  • 0

formula

  • C28H48O4

inchi

  • InChI=1S/C28H48O4/c1-11-17(3)13-19(5)26(30)21(7)15-23(9)28(32)24(10)16-22(8)27(31)20(6)14-18(4)25(29)12-2/h13-17,20-21,24,26-28,30-32H,11-12H2,1-10H3/b18-14+,19-13+,22-16+,23-15+/t17-,20-,21-,24-,26+,27-,28+/m0/s1

inchikey

  • MFSKGDFHTCLHJG-OXOPWONBSA-N

mass

  • 448.688

monoisotopicmass

  • 448.35526

smiles

  • O=C(/C(=C/[C@@H]([C@H](O)/C(=C/[C@@H]([C@H](O)/C(=C/[C@@H]([C@H](O)/C(=C/[C@H](CC)C)/C)C)/C)C)/C)C)/C)CC

subset

  • 2_STAR

synonym EXACT

  • (4E,6S,7S,8E,10S,11S,12E,14S,15S,16E,18S)-7,11,15-trihydroxy-4,6,8,10,12,14,16,18-octamethylicosa-4,8,12,16-tetraen-3-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:218370

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