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Substance Name: Ryanodol, 3-(1-butyl-1H-pyrrole-2-carboxylate)
RN: 106821-48-1
InChIKey: PHNJCRODANVSRH-AIVVSLIQSA-N

Molecular Weight

  • 549.6567
 
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Names and Synonyms

  • Ryanodol, 3-(1-butyl-1H-pyrrole-2-carboxylate)

Registry Numbers

CAS Registry Number

  • 106821-48-1

System Generated Number

  • 0106821481

Structure Descriptors

InChI

1S/C29H43NO9/c1-7-8-13-30-14-9-10-18(30)20(32)38-21-26(35,16(2)3)23(6)25(34)15-22(5)24(33)12-11-17(4)19(31)28(24,39-25)29(23,37)27(21,22)36/h9-10,14,16-17,19,21,31,33-37H,7-8,11-13,15H2,1-6H3/t17-,19+,21+,22-,23-,24-,25-,26+,27+,28+,29+/m0/s1

InChIKey

PHNJCRODANVSRH-AIVVSLIQSA-N

Smiles

n1(c(ccc1)C(O[C@@H]1[C@@]([C@@]2([C@@H](O)O[C@@]34[C@@H](O)[C@@H](CC[C@@]3(O)[C@@H]([C@@]1([C@@]24O)O)C)C)C)(O)C(C)C)=O)CCCC