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Substance Name: Jacoline
RN: 480-76-2
UNII: USC51AR5V5
InChIKey: FMWJEBGSMAOQNN-YLFNNMARSA-N

Molecular Formula

  • C18-H27-N-O7

Molecular Weight

  • 369.4113
 
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Names and Synonyms

Results Name

  • Jacoline

Name of Substance

  • Jacoline

Synonyms

  • (15alpha,20R)-12,15,20-Trihydroxy-15,20-dihydrosenecionan-11,16-dione
  • Jacoline
  • UNII-USC51AR5V5

Systematic Names

  • (1,6)Dioxacyclododecino(2,3,4-gh)pyrrolizine-2,7-dione, 3,4,5,6,9,11,13,14,14a,14b-decahydro-3,6-dihydroxy-3-((1R)-1-hydroxyethyl)-5,6-dimethyl-, (3R,5R,6S,14aR,14bR)-
  • Senecionan-11,16-dione, 15,20-dihydro-12,15,20-trihydroxy-, (15alpha,20R)-

Registry Numbers

CAS Registry Number

  • 480-76-2

FDA UNII

  • USC51AR5V5

System Generated Number

  • 0000480762

Structure Descriptors

InChI

1S/C18H27NO7/c1-10-8-18(24,11(2)20)16(22)26-13-5-7-19-6-4-12(14(13)19)9-25-15(21)17(10,3)23/h4,10-11,13-14,20,23-24H,5-9H2,1-3H3/t10-,11-,13-,14-,17-,18+/m1/s1

InChIKey

FMWJEBGSMAOQNN-YLFNNMARSA-N

Smiles

C[C@@H]1C[C@@](C(=O)O[C@@H]2CCN3[C@@H]2C(=CC3)COC(=O)[C@]1(C)O)([C@@H](C)O)O