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Substance Name: Aconitane-1,7,8,14-tetrol, 20-ethyl-4-(hydroxymethyl)-6,16-dimethoxy-, (1alpha,6beta,14alpha,16beta)-
RN: 71239-56-0
InChIKey: PNKADVXQUJDNSJ-UHFFFAOYSA-N

Molecular Weight

  • 439.545
 
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Names and Synonyms

  • Aconitane-1,7,8,14-tetrol, 20-ethyl-4-(hydroxymethyl)-6,16-dimethoxy-, (1alpha,6beta,14alpha,16beta)-

Registry Numbers

CAS Registry Number

  • 71239-56-0

System Generated Number

  • 0071239560

Structure Descriptors

InChI

1S/C23H37NO7/c1-4-24-9-20(10-25)6-5-14(26)22-12-7-11-13(30-2)8-21(28,15(12)16(11)27)23(29,19(22)24)18(31-3)17(20)22/h11-19,25-29H,4-10H2,1-3H3

InChIKey

PNKADVXQUJDNSJ-UHFFFAOYSA-N

Smiles

C1[C@@]2(O)[C@@H]3[C@@H]([C@@H]([C@@H]1OC)C[C@@H]3[C@@]13[C@@H]4[C@@]2([C@@H]([C@@H]1[C@@](CC[C@@H]3O)(CO)C[N@@]4CC)OC)O)O