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Substance Name: Gibberellic acid, methyl ester, 2-acetate 7-trifluoroacetate
RN: 1181-47-1
InChIKey: WHUUMMCTUGDPIP-IWHKTRFHSA-N

Molecular Formula

  • C24-H25-F3-O8

Molecular Weight

  • 498.4475
 
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Names and Synonyms

Results Name

  • Gibberellic acid, methyl ester, 2-acetate 7-trifluoroacetate

Synonym

  • 2beta,4a,7-Trihydroxy-1-methyl-8-methylene-4aalpha,4bbeta-Gibb-3-ene-1alpha,10beta-dicarboxylic acid 1,4a-lactone, methyl ester, 2-acetate 7-trifluoroacetate

Systematic Name

  • 4aalpha,4bbeta-Gibb-3-ene-1alpha,10beta-dicarboxylic acid, 2beta,4a,7-trihydroxy-1-methyl-8-methylene-, 1,4a-lactone, methyl ester, 2-acetate 7-trifluoroacetate

Registry Numbers

CAS Registry Number

  • 1181-47-1

System Generated Number

  • 0001181471

Structure Descriptors

InChI

1S/C24H25F3O8/c1-11-9-21-10-22(11,34-19(31)24(25,26)27)7-5-13(21)23-8-6-14(33-12(2)28)20(3,18(30)35-23)16(23)15(21)17(29)32-4/h6,8,13-16H,1,5,7,9-10H2,2-4H3/t13?,14-,15+,16+,20+,21-,22-,23+/m0/s1

InChIKey

WHUUMMCTUGDPIP-IWHKTRFHSA-N

Smiles

COC(=O)[C@H]1[C@@H]2[C@@]3(C)[C@@H](OC(=O)C)C=C[C@@]2(OC3=O)C4CC[C@@]5(C[C@]14CC5=C)OC(=O)C(F)(F)F