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Substance Name: Phorbol 12-phenylacetate 13-acetate 20-homovanillate
RN: 175796-50-6
InChIKey: OGRGWTXWAZBJKF-JXWJAAHMSA-N

Note

  • Behavior contrasts with resiniferatoxin and capsaicin in the lack of cooperativity in binding vanilloid (capsaicin) receptor.

Molecular Formula

  • C39-H44-O11

Molecular Weight

  • 688.7656
 
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Names and Synonyms

Name of Substance

  • Phorbol 12-phenylacetate 13-acetate 20-homovanillate

Synonym

  • PPAHV

Systematic Name

  • Benzeneacetic acid, 4-hydroxy-3-methoxy-, (9a-(acetyloxy)-1a,1b,4,4a,5,7a,7b,9,9a-decahydro-4a,7b-dihydroxy-1,1,6,8-tetramethyl-5-oxo-9-((phenylacetyl)oxy)-1H-cyclopropa(3,4)benz(1,2-e)azulen-3-yl)methyl ester, (1aR-(1aalpha,1bbeta,4abeta,7aalpha,7balpha,8alpha,9beta,9aalpha))-

Registry Numbers

CAS Registry Number

  • 175796-50-6

System Generated Number

  • 0175796506

Structure Descriptors

InChI

1S/C39H44O11/c1-21-14-30-37(45,34(21)44)19-26(20-48-31(42)18-25-12-13-28(41)29(16-25)47-6)15-27-33-36(4,5)39(33,50-23(3)40)35(22(2)38(27,30)46)49-32(43)17-24-10-8-7-9-11-24/h7-16,22,27,30,33,35,41,45-46H,17-20H2,1-6H3/t22-,27+,30-,33-,35-,37-,38-,39-/m1/s1

InChIKey

OGRGWTXWAZBJKF-JXWJAAHMSA-N

Smiles

COc1cc(CC(=O)OCC2=C[C@H]3[C@@H]4C(C)(C)[C@]4(OC(=O)C)[C@H](OC(=O)Cc5ccccc5)[C@@H](C)[C@]3(O)[C@@H]6C=C(C)C(=O)[C@@]6(O)C2)ccc1O