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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 > [(6e,11e)-3a,9,13-triacetyloxy-2,5,8,8,12-pentamethyl-4,10-dioxo-2,3,5,9,13,13a-hexahydro-1h-cyclopenta[12]annulen-1-yl] benzoate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > diterpenoid > [(6e,11e)-3a,9,13-triacetyloxy-2,5,8,8,12-pentamethyl-4,10-dioxo-2,3,5,9,13,13a-hexahydro-1h-cyclopenta[12]annulen-1-yl] benzoate

Preferred term

[(6e,11e)-3a,9,13-triacetyloxy-2,5,8,8,12-pentamethyl-4,10-dioxo-2,3,5,9,13,13a-hexahydro-1h-cyclopenta[12]annulen-1-yl] benzoate  

Type

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

Broader concept

charge

  • 0

formula

  • C33H40O10

inchi

  • InChI=1S/C33H40O10/c1-18-14-15-32(7,8)30(41-22(5)35)25(37)16-19(2)27(40-21(4)34)26-28(42-31(39)24-12-10-9-11-13-24)20(3)17-33(26,29(18)38)43-23(6)36/h9-16,18,20,26-28,30H,17H2,1-8H3/b15-14+,19-16+

inchikey

  • MVZQKKYLZHTDHU-VNXILKCPSA-N

mass

  • 596.673

monoisotopicmass

  • 596.26215

smiles

  • O(C12C(C(OC(=O)C3=CC=CC=C3)C(C1)C)C(OC(=O)C)C(C)=CC(=O)C(OC(=O)C)C(C=CC(C2=O)C)(C)C)C(=O)C

subset

  • 2_STAR

synonym EXACT

  • [(6E,11E)-3a,9,13-triacetyloxy-2,5,8,8,12-pentamethyl-4,10-dioxo-2,3,5,9,13,13a-hexahydro-1H-cyclopenta[12]annulen-1-yl] benzoate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:181070

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