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Substance Name: Browniine 14-acetate
RN: 65601-04-9
InChIKey: BQMFTYVYHRJVMQ-FAAGQOMASA-N

Molecular Formula

  • C27-H43-N-O8

Molecular Weight

  • 509.6357
 
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Names and Synonyms

Results Name

  • Browniine 14-acetate

Synonyms

  • 14-Acetylbrowniine
  • 14-O-Acetylbrowniine
  • Browniine 14-O-acetate

Systematic Names

  • Aconitane-7,8,14-triol, 20-ethyl-1,6,16-trimethoxy-4-(methoxymethyl)-, 14-acetate, (1alpha,6beta,14alpha,16beta)-
  • Browniine, acetate

Registry Numbers

CAS Registry Number

  • 65601-04-9

System Generated Number

  • 0065601049

Structure Descriptors

InChI

1S/C27H43NO8/c1-7-28-12-24(13-32-3)9-8-18(34-5)26-16-10-15-17(33-4)11-25(30,19(16)20(15)36-14(2)29)27(31,23(26)28)22(35-6)21(24)26/h15-23,30-31H,7-13H2,1-6H3/t15-,16?,17+,18-,19?,20+,21?,22+,23?,24+,25-,26+,27-/m1/s1

InChIKey

BQMFTYVYHRJVMQ-FAAGQOMASA-N

Smiles

CCN1C[C@@]2(CC[C@H]([C@@]34C2[C@@H]([C@@](C31)([C@]5(C[C@@H]([C@H]6CC4C5[C@H]6OC(=O)C)OC)O)O)OC)OC)COC