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Substance Name: 12-Deoxyphorbol-13-(4-acetoxyphenylacetate)-20-acetate
RN: 69883-99-4
InChIKey: WSORMWYCFRNUIA-UHFFFAOYSA-N

Classification Code

  • Skin / Eye Irritant

Molecular Formula

  • C32-H38-O9

Molecular Weight

  • 566.6432
 
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Names and Synonyms

Results Name

  • 12-Deoxyphorbol-13-(4-acetoxyphenylacetate)-20-acetate

Synonyms

  • 12-Deoxyphorbol-13-(4-acetoxyphenylacetate)-20-acetate
  • BRN 2931802

Systematic Name

  • 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-beta,7b-alpha,9a-alpha-trihydroxy-3-(hydroxymethyl)-1,1,6,8-alpha-tetramethyl-, 3-acetate 9a-(4-acetoxyphenylacetate)

Registry Numbers

CAS Registry Number

  • 69883-99-4

System Generated Number

  • 0069883994

Structure Descriptors

InChI

1S/C32H38O9/c1-17-11-25-30(37,28(17)36)15-22(16-39-19(3)33)12-24-27-29(5,6)31(27,14-18(2)32(24,25)38)41-26(35)13-21-7-9-23(10-8-21)40-20(4)34/h7-12,18,24-25,27,37-38H,13-16H2,1-6H3

InChIKey

WSORMWYCFRNUIA-UHFFFAOYSA-N

Smiles

CC1CC2(OC(=O)Cc3ccc(OC(=O)C)cc3)C(C4C=C(COC(=O)C)CC5(O)C(C=C(C)C5=O)C14O)C2(C)C