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Substance Name: Insularine
RN: 549-07-5
UNII: 60I96OKL0W
InChIKey: DPLLCJFNXPKFPB-FQLXRVMXSA-N

Molecular Formula

  • C38-H40-N2-O6

Molecular Weight

  • 620.742
 
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Names and Synonyms

Name of Substance

  • Insularine

Synonyms

  • 6,9-(Epoxymethano)-8,11:20,23-dietheno-1H,12H-(1,10)dioxacyclooctadecino(2,3,4-ij:11,12,13-i'j')diisoquinoline, 2,3,12a,13,14,15,24,24a-octahydro-5,17,18-trimethoxy-1,13-dimethyl-, (12aR,24aR)-
  • Insularine
  • Insularine [MI]
  • O-Methylinsulanoline
  • UNII-60I96OKL0W

Registry Numbers

CAS Registry Number

  • 549-07-5

FDA UNII

  • 60I96OKL0W

System Generated Number

  • 0000549075

Structure Descriptors

InChI

1S/C38H40N2O6/c1-39-14-13-25-20-32(42-4)36-38-34(25)28(39)17-22-6-9-27(10-7-22)45-37-33-24(19-31(41-3)35(37)43-5)12-15-40(2)29(33)18-23-8-11-30(46-38)26(16-23)21-44-36/h6-11,16,19-20,28-29H,12-15,17-18,21H2,1-5H3/t28-,29-/m1/s1

InChIKey

DPLLCJFNXPKFPB-FQLXRVMXSA-N

Smiles

CN1CCc2cc(c3c4c2[C@H]1Cc5ccc(cc5)Oc6c7c(cc(c6OC)OC)CCN([C@@H]7Cc8ccc(c(c8)CO3)O4)C)OC