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Substance Name: 12-O-Tetradecanoyl-phorbol-13-acetate-6-beta,7-beta-epoxide
RN: 56103-54-9
InChIKey: WWYBECWQTWFSHM-UHFFFAOYSA-N

Classification Code

  • Mutation Data

Molecular Formula

  • C36-H56-O9

Molecular Weight

  • 632.8294
 
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Names and Synonyms

Results Name

  • 12-O-Tetradecanoyl-phorbol-13-acetate-6-beta,7-beta-epoxide

Synonym

  • 12-O-Tetradecanoyl-phorbol-13-acetate-6-beta,7-beta-epoxide

Systematic Names

  • 4H-Cyclopropa(3,4)benz(1,2-e)oxireno(g)azulen-4-one, 1,1a-alpha,1b-beta,1C-alpha,2a-alpha,3,3a,6a-alpha,6b,7,8,8a-dodecahydro-3a-alpha,6b-alpha,8-beta,8a-alpha-tetrahydroxy-2a-(hydroxymethyl)-1,1,5,7-alpha-tetramethyl-, 8a-acetate 8-myristate
  • Tetradecanoic acid, 8a-(acetyloxy)-1a,1b,1c,2a,3,3a,4,6a,6b,7,8,8a-dodecahydro-3a,6b-dihydroxy-2a-(hydroxymethyl)-1,1,5,7-tetramethyl-4-oxo-1H-cyclopropa(5',6')benz(1',2':7,8)azuleno(5,6-b)oxiren-8-yl ester, (1aR-(1aalph,1bbeta,1calph,2aalph,3abeta,6aalpha,6balpha,7alpha,8beta,8aalpha))-

Registry Numbers

CAS Registry Number

  • 56103-54-9

System Generated Number

  • 0056103549

Structure Descriptors

InChI

1S/C36H56O9/c1-7-8-9-10-11-12-13-14-15-16-17-18-26(39)43-30-23(3)35(42)25-19-22(2)29(40)34(25,41)20-33(21-37)31(45-33)27(35)28-32(5,6)36(28,30)44-24(4)38/h19,23,25,27-28,30-31,37,41-42H,7-18,20-21H2,1-6H3

InChIKey

WWYBECWQTWFSHM-UHFFFAOYSA-N

Smiles

CCCCCCCCCCCCCC(=O)OC1C(C2(C3C=C(C(=O)C3(CC4(C(C2C5C1(C5(C)C)OC(=O)C)O4)CO)O)C)O)C