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Substance Name: Rotundine
RN: 6808-63-5
InChIKey: JLYWCHLTLCGOMW-LOACHALJSA-N

Molecular Formula

  • C19-H21-N-O4

Molecular Weight

  • 327.3779
 
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Names and Synonyms

Results Name

  • Rotundine

Synonym

  • Rotundine

Systematic Name

  • Dibenzo(a,e)cycloocten-5,11-imine-2,9-diol, 5,6,11,12-tetrahydro-3,8-dimethoxy-13-methyl, (5S)-

Registry Numbers

CAS Registry Number

  • 6808-63-5

System Generated Number

  • 0006808635

Structure Descriptors

InChI

1S/C19H21NO4/c1-20-14-4-10-6-16(21)19(24-3)9-13(10)15(20)5-11-7-18(23-2)17(22)8-12(11)14/h6-9,14-15,21-22H,4-5H2,1-3H3/t14?,15-/m0/s1

InChIKey

JLYWCHLTLCGOMW-LOACHALJSA-N

Smiles

N1(C2c3c(C[C@H]1c1c(C2)cc(c(c1)OC)O)cc(c(c3)O)OC)C