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Substance Name: Sambucoin
RN: 90044-34-1
InChIKey: ALCGWQGTELZSPT-XQLPTFJDSA-N

Molecular Formula

  • C15-H22-O3

Molecular Weight

  • 250.336
 
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Names and Synonyms

Results Name

  • Sambucoin

Synonym

  • Sambucoin

Systematic Name

  • Cyclopenta(c)(1)benzopyran-3(2H)-one, 1,3a,4,5a,8,9,9a,9b-octahydro-3a-hydroxy-7,9a,9b-trimethyl-, (3aS,5aS,9aR,9bR)-

Registry Numbers

CAS Registry Number

  • 90044-34-1

System Generated Number

  • 0090044341

Structure Descriptors

InChI

1S/C15H22O3/c1-10-4-6-13(2)12(8-10)18-9-15(17)11(16)5-7-14(13,15)3/h8,12,17H,4-7,9H2,1-3H3/t12-,13-,14+,15-/m0/s1

InChIKey

ALCGWQGTELZSPT-XQLPTFJDSA-N

Smiles

C1CC([C@@]2(CO[C@@H]3[C@@](CCC(C)=C3)([C@@]12C)C)O)=O