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Substance Name: Ent-13-epi-12-acetoxymanoyl oxide
RN: 122551-69-3
InChIKey: KZMQJOCDCYRIJB-BLQYKRGGSA-N

Note

  • Thromboxane B2 and leukotriene B4 antagonist isolated from the Spanish herb Sideritis javalambrensis.

Molecular Formula

  • C22-H36-O3

Molecular Weight

  • 348.5234
 
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Names and Synonyms

Name of Substance

  • Ent-13-epi-12-acetoxymanoyl oxide

Synonyms

  • (2R-(2alpha,3beta,4abeta,6aalpha,10abeta,10balpha))-3-Ethenyldodecahydro-3,4a,7,7,10a-pentamethyl-1H-naphtho(2,1-b)pyran-2-ol acetate
  • Manoyl oxide F1

Systematic Name

  • 1H-Naphtho(2,1-b)pyran-2-ol, 3-ethenyldodecahydro-3,4a,7,7,10a-pentamethyl-, acetate, (2R-(2alpha,3beta,4abeta,6aalpha,10abeta,10balpha))-

Registry Numbers

CAS Registry Number

  • 122551-69-3

System Generated Number

  • 0122551693

Structure Descriptors

InChI

1S/C22H36O3/c1-8-21(6)18(24-15(2)23)14-17-20(5)12-9-11-19(3,4)16(20)10-13-22(17,7)25-21/h8,16-18H,1,9-14H2,2-7H3/t16-,17+,18-,20-,21+,22+/m1/s1

InChIKey

KZMQJOCDCYRIJB-BLQYKRGGSA-N

Smiles

CC(=O)O[C@@H]1C[C@@H]2[C@](C)(CC[C@@H]3C(C)(C)CCC[C@@]23C)O[C@@]1(C)C=C