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Substance Name: Assafoetidnol B
RN: 403642-11-5
UNII: 18842MRL1M
InChIKey: CKPWNMFJQJVNER-DVITTYBWSA-N

Note

  • Sesquiterpene coumarin from the roots of Ferula assa-foetida.

Molecular Formula

  • C26-H32-O7

Molecular Weight

  • 456.5318
 
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Names and Synonyms

Name of Substance

  • Assafoetidnol B

Synonym

  • UNII-18842MRL1M

Registry Numbers

CAS Registry Number

  • 403642-11-5

FDA UNII

  • 18842MRL1M

System Generated Number

  • 0403642115

Structure Descriptors

InChI

1S/C26H32O7/c1-14-18(13-31-17-8-6-16-7-9-21(28)33-19(16)12-17)26(5)11-10-20(32-15(2)27)25(3,4)24(26)23(30)22(14)29/h6-9,12,18,20,22-24,29-30H,1,10-11,13H2,2-5H3/t18-,20-,22-,23+,24+,26-/m0/s1

InChIKey

CKPWNMFJQJVNER-DVITTYBWSA-N

Smiles

CC(=O)O[C@H]1CC[C@]2([C@H](C(=C)[C@@H]([C@H]([C@@H]2C1(C)C)O)O)COc3ccc4ccc(=O)oc4c3)C