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Substance Name: Stenophylline A
RN: 90541-57-4
InChIKey: NQQDXUQABFCHGS-HQSXMINWSA-N

Molecular Weight

  • 673.839
 
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Names and Synonyms

Name of Substance

  • Stenophylline A

Systematic Name

  • Stenophylline A

Registry Numbers

CAS Registry Number

  • 90541-57-4

Other Registry Number

  • 91450-13-4

System Generated Number

  • 0090541574

Structure Descriptors

InChI

1S/C37H55NO10/c1-18-6-7-24-21(4)27-23(17-38(24)16-18)22-15-36-29(28(22)35(46,30(27)40)11-9-20(3)32(43)44)25(39)14-26-33(36,5)12-13-34(45,37(26,47)48-36)10-8-19(2)31(41)42/h8-9,18,21-30,39-40,45-47H,6-7,10-17H2,1-5H3,(H,41,42)(H,43,44)/b19-8-,20-9-/t18-,21-,22-,23-,24-,25+,26?,27+,28?,29-,30+,33-,34-,35+,36?,37-/m0/s1

InChIKey

NQQDXUQABFCHGS-HQSXMINWSA-N

Smiles

C1[C@@]([C@@]2([C@@H]3C[C@H]([C@H]4[C@@H]5[C@]([C@@H]([C@@H]6[C@@H](C)[C@@H]7CC[C@H](C)C[N@@]7C[C@@H]6[C@@H]5C[C@@]4([C@@]3(C1)C)O2)O)(O)C\C=C(/C(=O)O)C)O)O)(O)C\C=C(/C(=O)O)C