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Chemistry, part 2

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

Preferred term

higginsianin e  

Type

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

Broader concept

charge

  • 0

formula

  • C28H42O5

inchi

  • InChI=1S/C28H42O5/c1-17(2)10-9-14-27(7)22-12-11-18(3)21(26(22,6)15-13-23(27)29)16-28(25(31)32-8)24(30)19(4)20(5)33-28/h10,21-23,29H,3,9,11-16H2,1-2,4-8H3/t21-,22-,23-,26-,27+,28-/m1/s1

inchikey

  • WZUFZZRYXAGLOG-ZPDDIMPJSA-N

mass

  • 458.639

monoisotopicmass

  • 458.30322

smiles

  • O=C1C(=C(C)O[C@]1(C(=O)OC)C[C@@H]2C(=C)CC[C@@H]3[C@@]2(CC[C@H]([C@]3(CCC=C(C)C)C)O)C)C

subset

  • 2_STAR

synonym EXACT

  • methyl (2R)-2-[[(1R,4aR,5S,6R,8aR)-6-hydroxy-5,8a-dimethyl-2-methylidene-5-(4-methylpent-3-enyl)-3,4,4a,6,7,8-hexahydro-1H-naphthalen-1-yl]methyl]-4,5-dimethyl-3-oxouran-2-carboxylate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:225940

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