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Chemistry, part 2

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Concept information

... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > organic heteropentacyclic compound > 12-o-acetyl-16-o-deacetyl-16-epi-scalarobutenolide
... > 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 > organic heteropolycyclic compound > organic heteropentacyclic compound > 12-o-acetyl-16-o-deacetyl-16-epi-scalarobutenolide
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > organic heteropolycyclic compound > organic heteropentacyclic compound > 12-o-acetyl-16-o-deacetyl-16-epi-scalarobutenolide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic hydroxy compound > alcohol > secondary alcohol > 12-o-acetyl-16-o-deacetyl-16-epi-scalarobutenolide
... > chemical entity > molecular entity > polyatomic entity > heteroatomic molecular entity > hydroxides > organic hydroxy compound > alcohol > secondary alcohol > 12-o-acetyl-16-o-deacetyl-16-epi-scalarobutenolide
... > organooxygen compound > ester > carboxylic ester > lactone > gamma-lactone > 12-o-acetyl-16-o-deacetyl-16-epi-scalarobutenolide
... > organooxygen compound > carbonyl compound > carboxylic ester > lactone > gamma-lactone > 12-o-acetyl-16-o-deacetyl-16-epi-scalarobutenolide
... > 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 > gamma-lactone > 12-o-acetyl-16-o-deacetyl-16-epi-scalarobutenolide
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > lactone > gamma-lactone > 12-o-acetyl-16-o-deacetyl-16-epi-scalarobutenolide
organooxygen compound > ester > lactone > gamma-lactone > 12-o-acetyl-16-o-deacetyl-16-epi-scalarobutenolide
organooxygen compound > oxacycle > lactone > gamma-lactone > 12-o-acetyl-16-o-deacetyl-16-epi-scalarobutenolide
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > gamma-lactone > 12-o-acetyl-16-o-deacetyl-16-epi-scalarobutenolide
... > 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 > gamma-lactone > 12-o-acetyl-16-o-deacetyl-16-epi-scalarobutenolide
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic heterocyclic compound > oxacycle > lactone > gamma-lactone > 12-o-acetyl-16-o-deacetyl-16-epi-scalarobutenolide
organooxygen compound > ester > carboxylic ester > acetate ester > 12-o-acetyl-16-o-deacetyl-16-epi-scalarobutenolide
organooxygen compound > carbonyl compound > carboxylic ester > acetate ester > 12-o-acetyl-16-o-deacetyl-16-epi-scalarobutenolide
... > 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 > acetate ester > 12-o-acetyl-16-o-deacetyl-16-epi-scalarobutenolide
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic oxo compound > carbonyl compound > carboxylic ester > acetate ester > 12-o-acetyl-16-o-deacetyl-16-epi-scalarobutenolide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > isoprenoid > terpenoid > sesterterpenoid > scalarane sesterterpenoid > 12-o-acetyl-16-o-deacetyl-16-epi-scalarobutenolide
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > isoprenoid > terpenoid > sesterterpenoid > scalarane sesterterpenoid > 12-o-acetyl-16-o-deacetyl-16-epi-scalarobutenolide

Preferred term

12-o-acetyl-16-o-deacetyl-16-epi-scalarobutenolide  

Type

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

Broader concept

alt_id

  • CHEBI:66062

charge

  • 0

formula

  • C27H40O5

has_role

inchi

  • InChI=1S/C27H40O5/c1-15(28)31-21-14-19-25(4)10-7-9-24(2,3)18(25)8-11-26(19,5)20-13-17(29)16-12-22(30)32-23(16)27(20,21)6/h12,17-21,23,29H,7-11,13-14H2,1-6H3/t17-,18-,19+,20-,21+,23-,25-,26+,27+/m0/s1

inchikey

  • TUHLUXIESILORF-ZWRXBZFVSA-N

mass

  • 444.60350

monoisotopicmass

  • 444.28757

smiles

  • [H][C@]12OC(=O)C=C1[C@@H](O)C[C@@]1([H])[C@]3(C)CC[C@@]4([H])C(C)(C)CCC[C@]4(C)[C@@]3([H])C[C@@H](OC(C)=O)[C@]21C

subset

  • 3_STAR

synonym EXACT

  • (4S,5aS,5bR,7aS,11aS,11bR,13R,13aR,13bS)-4-hydroxy-5b,8,8,11a,13a-pentamethyl-2-oxo-2,4,5,5a,5b,6,7,7a,8,9,10,11,11a,11b,12,13,13a,13b-octadecahydrochryseno[1,2-b]furan-13-yl acetate

synonym RELATED

  • Hyrtios sesterterpene 2

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:65366

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