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Substance Name: Ambiguine
RN: 68388-52-3
InChIKey: PZQUJIBUDVFDII-UHFFFAOYSA-N

Molecular Formula

  • C28-H45-N-O8

Molecular Weight

  • 523.662
 
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Names and Synonyms

Results Name

  • Ambiguine

Synonym

  • Ambiguine

Systematic Name

  • Aconitane-7,14-diol, 20-ethyl-1,6,8,16-tetramethoxy-4-(methoxymethyl)-,14-acetate, (1alpha,6beta,14alpha,16beta)-

Registry Numbers

CAS Registry Number

  • 68388-52-3

System Generated Number

  • 0068388523

Structure Descriptors

InChI

1S/C28H45NO8/c1-7-29-14-25(10-11-33-3)9-8-19(31)27-17-12-16-18(34-4)13-26(36-6,20(17)21(16)37-15(2)30)28(32,24(27)29)23(35-5)22(25)27/h16-24,31-32H,7-14H2,1-6H3

InChIKey

PZQUJIBUDVFDII-UHFFFAOYSA-N

Smiles

C(COC)[C@@]12[C@@H]3[C@@H](OC)[C@@]4(O)[C@@H]([C@@]3([C@@H]3[C@@H]5[C@@]4(C[C@@H]([C@@H]([C@@H]5OC(=O)C)C3)OC)OC)[C@@H](O)CC1)[N@@](CC)C2