Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: TPA-20-tetradecanoate
RN: 63533-70-0
InChIKey: SCKGCFZOPIYMSK-TXSUOPFHSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C50-H81-O9

Molecular Weight

  • 827.1888
 
* denotes mobile formatted website

Links to Resources

NLM Resources (File Locators)

Other Resources (Internet Locators)


Search for this InChIKey on the Web

Names and Synonyms

Results Name

  • TPA-20-tetradecanoate

Synonyms

  • CCRIS 4897
  • TPA-20-tetradecanoate

Systematic Names

  • 12-O-Tetradecanoylphorbol-13-acetate-20-tetradecanoate
  • 5H-Cyclopropa(3,4)benz(1,2-e)azulen-5-one, 1,1a-alpha,1b-beta,4,4a,7a-alpha,7b,8,9,9a-decahydro-4a-alpha,7b-alpha,9-beta,9a-alpha-tetrahydroxy-1,1,6,8-alpha-tetramethyl-3-tetradecanoyloxymethyl-, 9a-acetate, 9-tetradecanoate

Registry Numbers

CAS Registry Number

  • 63533-70-0

System Generated Number

  • 0063533700

Structure Descriptors

InChI

1S/C50H82O9/c1-8-10-12-14-16-18-20-22-24-26-28-30-42(52)57-35-39-33-40-44-47(6,7)50(44,59-38(5)51)46(37(4)49(40,56)41-32-36(3)45(54)48(41,55)34-39)58-43(53)31-29-27-25-23-21-19-17-15-13-11-9-2/h32-33,37,40-41,44,46,55-56H,8-31,34-35H2,1-7H3/t37-,40+,41-,44?,46-,48+,49-,50?/m1/s1

InChIKey

SCKGCFZOPIYMSK-TXSUOPFHSA-N

Smiles

CCCCCCCCCCCCCC(=O)OCC1=C[C@H]2C3C(C3([C@@H]([C@H]([C@@]2([C@@H]4C=C(C(=O)[C@@]4(C1)O)C)O)C)OC(=O)CCCCCCCCCCCCC)OC(=O)C)(C)C