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Substance Name: N-Syringoyldihydrocyclomicrophylline F
RN: 115392-78-4
InChIKey: DLMNMDWSPBXDSA-PGDUPEJSSA-N

Molecular Formula

  • C35-H54-N2-O6

Molecular Weight

  • 598.8196
 
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Names and Synonyms

  • N-Syringoyldihydrocyclomicrophylline F

Registry Numbers

CAS Registry Number

  • 115392-78-4

System Generated Number

  • 0115392784

Structure Descriptors

InChI

1S/C35H54N2O6/c1-20(37(5)6)28-22(39)17-33(4)26-10-9-25-31(2,19-38)27(11-12-34(25)18-35(26,34)14-13-32(28,33)3)36-30(41)21-15-23(42-7)29(40)24(16-21)43-8/h15-16,20,22,25-28,38-40H,9-14,17-19H2,1-8H3,(H,36,41)/t20-,22+,25-,26-,27-,28-,31+,32+,33-,34+,35-/m0/s1

InChIKey

DLMNMDWSPBXDSA-PGDUPEJSSA-N

Smiles

COc1cc(cc(OC)c1O)C(=O)N[C@H]2CC[C@]34C[C@]35CC[C@]6(C)[C@@H]([C@H](C)N(C)C)[C@H](O)C[C@@]6(C)[C@@H]5CC[C@H]4[C@@]2(C)CO