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Contact us: CRM@email.irandoc.ac.ir

Concept information

Preferred term

aromoline  

Type

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

charge

  • 0

formula

  • C36H38N2O6

inchi

  • InChI=1S/C36H38N2O6/c1-37-13-11-23-18-32(41-3)33-19-26(23)28(37)16-22-7-10-30(39)31(17-22)43-24-8-5-21(6-9-24)15-29-27-20-34(44-33)35(40)36(42-4)25(27)12-14-38(29)2/h5-10,17-20,28-29,39-40H,11-16H2,1-4H3/t28-,29+/m0/s1

inchikey

  • ZVVVPJJQRQNTAT-URLMMPGGSA-N

mass

  • 594.698

monoisotopicmass

  • 594.27299

smiles

  • COc1cc2CCN(C)[C@H]3Cc4ccc(O)c(Oc5ccc(C[C@H]6N(C)CCc7c6cc(Oc1cc23)c(O)c7OC)cc5)c4

subset

  • 2_STAR

synonym EXACT

  • Aromoline

In other languages

URI

http://www.irandoc.acir/onto/irandoc/CHEBI:2842

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