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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 > lipid > steroid > estra-1,3,5-(10)-trien-17-one-3-oxyacetic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > organic cyclic compound > organic polycyclic compound > steroid > estra-1,3,5-(10)-trien-17-one-3-oxyacetic acid
... > 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 > estra-1,3,5-(10)-trien-17-one-3-oxyacetic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > organic polycyclic compound > steroid > estra-1,3,5-(10)-trien-17-one-3-oxyacetic acid
... > chemical entity > molecular entity > polyatomic entity > molecule > cyclic compound > polycyclic compound > organic polycyclic compound > steroid > estra-1,3,5-(10)-trien-17-one-3-oxyacetic acid

Preferred term

estra-1,3,5-(10)-trien-17-one-3-oxyacetic acid  

Type

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

Broader concept

charge

  • 0

formula

  • C20H24O4

has_parent_hydride

inchi

  • InChI=1S/C20H24O4/c1-20-9-8-15-14-5-3-13(24-11-19(22)23)10-12(14)2-4-16(15)17(20)6-7-18(20)21/h3,5,10,15-17H,2,4,6-9,11H2,1H3,(H,22,23)/t15-,16-,17+,20+/m1/s1

inchikey

  • XSDCLHQDGODZPZ-WWNBULGVSA-N

mass

  • 328.40220

monoisotopicmass

  • 328.16746

smiles

  • C[C@]12CC[C@H]3[C@@H](CCc4cc(OCC(O)=O)ccc34)[C@@H]1CCC2=O

subset

  • 2_STAR

synonym RELATED

  • 3-O-(Carboxymethyl)estrone

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:79692

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