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Concept information

Preferred term

decaturin d  

Type

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

Broader concept

charge

  • 0

formula

  • C30H35NO4

inchi

  • InChI=1S/C30H35NO4/c1-18-8-9-24-28(4)12-11-25(32)27(2,3)23(28)10-13-29(24,5)30(18)16-20-22(35-30)15-21(34-26(20)33)19-7-6-14-31-17-19/h6-8,14-15,17,23-24H,9-13,16H2,1-5H3/t23-,24+,28-,29+,30-/m0/s1

inchikey

  • AHYSWFBBMLPXFU-XBRQCBKPSA-N

mass

  • 473.613

monoisotopicmass

  • 473.25661

smiles

  • O=C1OC(C2=CN=CC=C2)=CC3=C1C[C@@]4(C(=CC[C@H]5[C@]4(CC[C@@H]6[C@@]5(CCC(C6(C)C)=O)C)C)C)O3

subset

  • 2_STAR

synonym EXACT

  • (2S,4'aR,4'bR,8'aR,10'aR)-1',1',4'a,7',8'a-pentamethyl-6-pyridin-3-ylspiro[3H-uro[3,2-c]pyran-2,8'-4,4b,5,9,10,10a-hexahydro-3H-phenanthrene]-2',4-dione

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:225642

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