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Substance Name: Passicoccin
RN: 99694-22-1
InChIKey: AFTIHDWVYIIJKS-GGJZXZOSSA-N

Molecular Weight

  • 513.47
 
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Names and Synonyms

  • Passicoccin

Registry Numbers

CAS Registry Number

  • 99694-22-1

System Generated Number

  • 0099694221

Structure Descriptors

InChI

1S/C18H27NO14S/c1-7-10(20)12(22)14(24)16(30-7)29-5-9-11(21)13(23)15(25)17(31-9)32-18(6-19)3-2-8(4-18)33-34(26,27)28/h2-3,7-17,20-25H,4-5H2,1H3,(H,26,27,28)/t7-,8?,9-,10-,11-,12+,13+,14+,15-,16-,17+,18?/m1/s1

InChIKey

AFTIHDWVYIIJKS-GGJZXZOSSA-N

Smiles

C=1[C@@](C[C@@H](C1)OS(=O)(=O)O)(C#N)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@H](O1)CO[C@H]1[C@@H](O)[C@@H](O)[C@H](O)[C@H](O1)C