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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 > terpene lactone > 2a-oxa-2oxo-5a-hydroxy-3,4-dinor-24-ethylcholesta-24(28)-ene
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > terpene lactone > 2a-oxa-2oxo-5a-hydroxy-3,4-dinor-24-ethylcholesta-24(28)-ene
... > organooxygen compound > ester > carboxylic ester > lactone > terpene lactone > 2a-oxa-2oxo-5a-hydroxy-3,4-dinor-24-ethylcholesta-24(28)-ene
... > organooxygen compound > carbonyl compound > carboxylic ester > lactone > terpene lactone > 2a-oxa-2oxo-5a-hydroxy-3,4-dinor-24-ethylcholesta-24(28)-ene
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > lactone > terpene lactone > 2a-oxa-2oxo-5a-hydroxy-3,4-dinor-24-ethylcholesta-24(28)-ene
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > lactone > terpene lactone > 2a-oxa-2oxo-5a-hydroxy-3,4-dinor-24-ethylcholesta-24(28)-ene
organooxygen compound > ester > lactone > terpene lactone > 2a-oxa-2oxo-5a-hydroxy-3,4-dinor-24-ethylcholesta-24(28)-ene
organooxygen compound > oxacycle > lactone > terpene lactone > 2a-oxa-2oxo-5a-hydroxy-3,4-dinor-24-ethylcholesta-24(28)-ene
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > terpene lactone > 2a-oxa-2oxo-5a-hydroxy-3,4-dinor-24-ethylcholesta-24(28)-ene
... > 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 > lactone > terpene lactone > 2a-oxa-2oxo-5a-hydroxy-3,4-dinor-24-ethylcholesta-24(28)-ene
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > terpene lactone > 2a-oxa-2oxo-5a-hydroxy-3,4-dinor-24-ethylcholesta-24(28)-ene

Preferred term

2a-oxa-2oxo-5a-hydroxy-3,4-dinor-24-ethylcholesta-24(28)-ene  

Type

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

Broader concept

charge

  • 0

formula

  • C27H44O3

inchi

  • InChI=1S/C27H44O3/c1-7-19(17(2)3)9-8-18(4)21-10-11-22-20-12-15-27(29)26(6,16-24(28)30-27)23(20)13-14-25(21,22)5/h7,17-18,20-23,29H,8-16H2,1-6H3/b19-7+/t18-,20+,21-,22+,23+,25-,26-,27-/m1/s1

inchikey

  • LJBNXGCIASRMAO-RHZHZYLJSA-N

mass

  • 416.646

monoisotopicmass

  • 416.32905

smiles

  • O=C1O[C@]2(O)CC[C@@H]3[C@@H]([C@]2(C1)C)CC[C@]4([C@H]3CC[C@@H]4[C@@H](CC/C(=C/C)/C(C)C)C)C

subset

  • 2_STAR

synonym EXACT

  • (3aR,3bS,5aR,6R,8aS,8bS,10aR)-10a-hydroxy-3a,5a-dimethyl-6-[(E,2R)-5-propan-2-ylhept-5-en-2-yl]-3b,4,5,6,7,8,8a,8b,9,10-decahydro-3H-indeno[5,4-e][1]benzouran-2-one

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:201246

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