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Substance Name: Karasamine
RN: 84714-33-0
InChIKey: PEUHZLSMLRCFJM-RLDBGSGHSA-N

Note

  • From Aconitum karakolicum var. patentipilum W.T. Wang.

Molecular Formula

  • C23-H37-N-O4

Molecular Weight

  • 391.5483
 
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Names and Synonyms

Name of Substance

  • Karasamine

Systematic Name

  • Aconitane-1,8-diol, 20-ethyl-14,16-dimethoxy-4-methyl-, (1alpha,14alpha,16beta)-

Registry Numbers

CAS Registry Number

  • 84714-33-0

System Generated Number

  • 0084714330

Structure Descriptors

InChI

1S/C23H37NO4/c1-5-24-11-21(2)7-6-17(25)23-13-8-12-15(27-3)10-22(26,18(13)19(12)28-4)14(20(23)24)9-16(21)23/h12-20,25-26H,5-11H2,1-4H3/t12-,13-,14+,15?,16-,17+,18-,19+,20?,21?,22+,23-/m1/s1

InChIKey

PEUHZLSMLRCFJM-RLDBGSGHSA-N

Smiles

CCN1CC2(CC[C@@H]([C@@]34[C@@H]2C[C@@H](C31)[C@]5(CC([C@H]6C[C@@H]4[C@@H]5[C@H]6OC)OC)O)O)C