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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 > carbocyclic compound > carbopolycyclic compound > carbobicyclic compound > ortho-fused bicyclic hydrocarbon > indene > cyanosporaside d
... > chemical entity > molecular entity > main group molecular entity > p-block molecular entity > carbon group molecular entity > organic molecular entity > organic molecule > organic cyclic compound > carbocyclic compound > carbopolycyclic compound > carbobicyclic compound > ortho-fused bicyclic hydrocarbon > indene > cyanosporaside d
... > chemical entity > molecular entity > polyatomic entity > molecule > organic molecule > organic cyclic compound > carbocyclic compound > carbopolycyclic compound > carbobicyclic compound > ortho-fused bicyclic hydrocarbon > indene > cyanosporaside d

Preferred term

cyanosporaside d  

Type

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

Broader concept

charge

  • 0

formula

  • C16H12ClNO3

inchi

  • InChI=1S/C16H12ClNO3/c1-9(19)21-15-3-2-11-8-12-13(16(11,15)20)6-10(4-5-18)7-14(12)17/h2-3,6-8,15,20H,4H2,1H3/t15-,16+/m0/s1

inchikey

  • BDIOOCOCCOXOLZ-JKSUJKDBSA-N

mass

  • 301.730

monoisotopicmass

  • 301.05057

smiles

  • ClC1=C2C(=CC(=C1)CC#N)[C@@]3(O)[C@@H](OC(=O)C)C=CC3=C2

subset

  • 2_STAR

synonym EXACT

  • [(1S,8bR)-5-chloro-7-(cyanomethyl)-8b-hydroxy-1H-cyclopenta[a]inden-1-yl] acetate

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:213845

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