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Substance Name: Atherospermoline
RN: 21008-67-3
InChIKey: XGEAUXVPBXUBKN-NSOVKSMOSA-N

Molecular Formula

  • C36-H38-N2-O6

Molecular Weight

  • 594.704
 
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Names and Synonyms

Results Name

  • Atherospermoline

Synonym

  • Atherospermoline

Systematic Names

  • 16H-1,24:6,9-Dietheno-11,15-metheno-2H- pyrido(2',3':17,18)(1,11)dioxacycloeicosino(2,3,4-ij)isoquinoline-12,22-diol, 3,4,4a,5,16a,17,18,19-octahydro-21,26-dimethoxy-4,17-dimethyl-, (4aS-(4aR*,16aR*))-
  • Berbaman-7,12-diol, 6,6'-dimethoxy-2,2'-dimethyl-, (1beta)-

Registry Numbers

CAS Registry Number

  • 21008-67-3

System Generated Number

  • 0021008673

Structure Descriptors

InChI

1S/C36H38N2O6/c1-37-13-11-23-18-31(41-3)32-20-26(23)27(37)15-21-5-8-25(9-6-21)43-30-17-22(7-10-29(30)39)16-28-34-24(12-14-38(28)2)19-33(42-4)35(40)36(34)44-32/h5-10,17-20,27-28,39-40H,11-16H2,1-4H3/t27-,28-/m0/s1

InChIKey

XGEAUXVPBXUBKN-NSOVKSMOSA-N

Smiles

c1c2c3c(c(c1OC)O)Oc1c(cc4c([C@@H]([N@@](CC4)C)Cc4ccc(Oc5c(ccc(C[C@@H]3[N@@](C)CC2)c5)O)cc4)c1)OC