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Chemistry, part 2

Content language

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Concept information

organooxygen compound > ester > steroid ester > estra-1,3,5(10)-triene-3,6alpha,17beta-triol triacetate
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > lipid > steroid > steroid ester > estra-1,3,5(10)-triene-3,6alpha,17beta-triol triacetate
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > steroid > steroid ester > estra-1,3,5(10)-triene-3,6alpha,17beta-triol triacetate
... > 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 polycyclic compound > steroid > steroid ester > estra-1,3,5(10)-triene-3,6alpha,17beta-triol triacetate
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > steroid ester > estra-1,3,5(10)-triene-3,6alpha,17beta-triol triacetate
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > steroid > steroid ester > estra-1,3,5(10)-triene-3,6alpha,17beta-triol triacetate

Preferred term

estra-1,3,5(10)-triene-3,6alpha,17beta-triol triacetate  

Type

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

Broader concept

charge

  • 0

formula

  • C24H30O6

inchi

  • InChI=1S/C24H30O6/c1-13(25)28-16-5-6-17-18-9-10-24(4)21(7-8-23(24)30-15(3)27)19(18)12-22(20(17)11-16)29-14(2)26/h5-6,11,18-19,21-23H,7-10,12H2,1-4H3/t18-,19-,21+,22+,23+,24+/m1/s1

inchikey

  • LMXGPAGGDXVARU-ULHSUKCYSA-N

mass

  • 414.49140

monoisotopicmass

  • 414.20424

smiles

  • CC(=O)O[C@H]1CC[C@H]2[C@@H]3C[C@H](OC(C)=O)c4cc(OC(C)=O)ccc4[C@H]3CC[C@]12C

subset

  • 2_STAR

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:79883

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