SpectraBase Compound ID | 2hHbqRkXutK |
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InChI | InChI=1S/C35H48O10/c1-18-27(36)28(37)29(38)32(44-18)45-21-10-13-33(2)20(17-21)7-9-26-25(33)11-14-34(3)24(12-15-35(26,34)41)19-6-8-22(30(39)42-4)23(16-19)31(40)43-5/h6,8,16-18,21,24-29,32,36-38,41H,7,9-15H2,1-5H3/t18-,21-,24+,25-,26+,27-,28+,29+,32+,33-,34+,35+/m0/s1 |
InChIKey | CGTULPPTFFMMBL-DKIRADODSA-N |
Mol Weight | 628.8 g/mol |
Molecular Formula | C35H48O10 |
Exact Mass | 628.324748 g/mol |
SpectraBase Spectrum ID | HCrzaqhesy |
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Name | DIMETHYL-4-[3-BETA-[(6-DEOXY-ALPHA-L-MANNOPYRANOSYL)-OXY]-14-BETA-HYDROXYANDROST-4-EN-17-BETA-YL]-PHTHALATE |
Copyright | Copyright © 2016-2024 W. Robien, Inst. of Org. Chem., Univ. of Vienna. All Rights Reserved. |
Formula | C35H48O10 |
InChI | InChI=1S/C35H48O10/c1-18-27(36)28(37)29(38)32(44-18)45-21-10-13-33(2)20(17-21)7-9-26-25(33)11-14-34(3)24(12-15-35(26,34)41)19-6-8-22(30(39)42-4)23(16-19)31(40)43-5/h6,8,16-18,21,24-29,32,36-38,41H,7,9-15H2,1-5H3/t18-,21-,24+,25-,26+,27-,28+,29+,32+,33-,34+,35+/m0/s1 |
InChIKey | CGTULPPTFFMMBL-DKIRADODSA-N |
Literature Reference Author | J.MORI,S.I.NAGAI,J.SAKAKIBARA,K.TAKEYA,Y.HOTTA |
Literature Reference Citation | CHEM.PHARM.BULL.,36,48(1988) |
Literature Reference DOI | 10.1248/cpb.36.48 |
Molecular Weight | 628.760 g/mol |
Solvent | CDCl3:DMSO-D6=2:1 |
Source File Reference | UWBK1316 |