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Substance Name: Daphnandrine
RN: 1183-76-2
UNII: P9909Y937X
InChIKey: REKCBEFSIKOPTD-IZLXSDGUSA-N

Molecular Formula

  • C36-H38-N2-O6

Molecular Weight

  • 594.7042
 
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Names and Synonyms

Name of Substance

  • Daphnandrine

Synonym

  • UNII-P9909Y937X

Systematic Name

  • Oxyacanthan-7-ol, 6,6',12'-trimethoxy-2-methyl-

Registry Numbers

CAS Registry Number

  • 1183-76-2

FDA UNII

  • P9909Y937X

System Generated Number

  • 0001183762

Structure Descriptors

InChI

1S/C36H38N2O6/c1-38-14-12-24-19-33(42-4)35(39)36-34(24)28(38)16-21-5-8-25(9-6-21)43-31-17-22(7-10-29(31)40-2)15-27-26-20-32(44-36)30(41-3)18-23(26)11-13-37-27/h5-10,17-20,27-28,37,39H,11-16H2,1-4H3/t27-,28+/m1/s1

InChIKey

REKCBEFSIKOPTD-IZLXSDGUSA-N

Smiles

CN1CCc2cc(c(c3c2[C@@H]1Cc4ccc(cc4)Oc5cc(ccc5OC)C[C@@H]6c7cc(c(cc7CCN6)OC)O3)O)OC