SpectraBase Compound ID | DODqpm08UqU |
---|---|
InChI | InChI=1S/C30H50O6/c1-25(2)13-18-17-7-8-20-26(3)11-10-21(33)27(4,15-31)19(26)9-12-28(20,5)29(17,6)14-22(34)30(18,16-32)24(36)23(25)35/h7,18-24,31-36H,8-16H2,1-6H3/t18-,19+,20+,21-,22+,23-,24-,26-,27+,28+,29+,30-/m0/s1 |
InChIKey | VKJLHZZPVLQJKG-JAGYOTNFSA-N |
Mol Weight | 506.7 g/mol |
Molecular Formula | C30H50O6 |
Exact Mass | 506.360739 g/mol |
SpectraBase Spectrum ID | Ag67JbJIiVC |
---|---|
Name | PROTOESCIGENIN |
Compound Number | 1 |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C30H50O6 |
InChI | InChI=1S/C30H50O6/c1-25(2)13-18-17-7-8-20-26(3)11-10-21(33)27(4,15-31)19(26)9-12-28(20,5)29(17,6)14-22(34)30(18,16-32)24(36)23(25)35/h7,18-24,31-36H,8-16H2,1-6H3/t18-,19+,20+,21-,22+,23-,24-,26-,27+,28+,29+,30-/m0/s1 |
InChIKey | VKJLHZZPVLQJKG-JAGYOTNFSA-N |
Literature Reference Author | M.M.GRUZA,K.JATEZAK,B.ZAGRODZKI,M.LASZCZ,K.KOZIAK,M.MALINSKA ,P.CMOCH,T.GILLER |
Literature Reference Citation | MOLECULES,18,4389(2013) |
Literature Reference DOI | 10.3390/molecules18044389 |
Molecular Weight | 506.723 g/mol |
Solvent | DMSO-D6 |
Source File Reference | UWBT9163 |