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Substance Name: Spegatrine
RN: 47326-53-4
InChIKey: DOTYYDUNWITJSJ-SYMHJQAPSA-O

Molecular Formula

  • C20-H25-N2-O2

Molecular Weight

  • 325.43
 
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Names and Synonyms

Name of Substance

  • Spegatrine

Systematic Name

  • Sarpaganium, 10,17-dihydroxy-4-methyl-

Registry Numbers

CAS Registry Number

  • 47326-53-4

System Generated Number

  • 0047326534

Structure Descriptors

InChI

1S/C20H24N2O2/c1-3-11-9-22(2)18-8-15-14-6-12(24)4-5-17(14)21-20(15)19(22)7-13(11)16(18)10-23/h3-6,13,16,18-19,21,23H,7-10H2,1-2H3/p+1/b11-3-/t13-,16-,18?,19+,22?/m1/s1

InChIKey

DOTYYDUNWITJSJ-SYMHJQAPSA-O

Smiles

c12c([C@@H]3C[C@@H]4\C(C[N@@+]3(C)[C@@H]([C@@H]4CO)C2)=C/C)[nH]c2ccc(cc12)O