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Substance Name: Prostratin
RN: 60857-08-1
InChIKey: BOJKFRKNLSCGHY-KKFGZBDXSA-N

Molecular Formula

  • C22-H30-O6

Molecular Weight

  • 390.473
 
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Names and Synonyms

Name of Substance

  • Prostratin

Synonyms

  • CCRIS 6292
  • NSC 623310

Systematic Names

  • 6H-Cyclopropa(3,4)benz(1,2-e)azulen-6-one, 9a-(acetyloxy)-1,1a,1b,4,4a,7a,7b,8,9,9a-decahydro-4a,7b-dihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-, (1aR,1bS,4aR,7aS,7bR,8R,9aS)-
  • 6H-Cyclopropa(3,4)benz(1,2-e)azulen-6-one, 9a-(acetyloxy)-1,1a,1b,4,4a,7a,7b,8,9,9a-decahydro-4a,7b-dihydroxy-3-(hydroxymethyl)-1,1,6,8-tetramethyl-, (1aR-(1aalpha,1bbeta,4abeta,7aalpha,8alpha,9aalpha))-
  • Prostratin

Registry Numbers

CAS Registry Number

  • 60857-08-1

System Generated Number

  • 0060857081

Structure Descriptors

InChI

1S/C22H30O6/c1-11-6-16-20(26,18(11)25)9-14(10-23)7-15-17-19(4,5)21(17,28-13(3)24)8-12(2)22(15,16)27/h6-7,12,15-17,23,26-27H,8-10H2,1-5H3/t12-,15+,16-,17?,20-,21?,22-/m1/s1

InChIKey

BOJKFRKNLSCGHY-KKFGZBDXSA-N

Smiles

C[C@@H]1CC2(OC(=O)C)C([C@@H]3C=C(CO)C[C@@]4(O)[C@@H](C=C(C)C4=O)[C@@]13O)C2(C)C