SpectraBase Compound ID | AVQtT2IiWEK |
---|---|
InChI | InChI=1S/C29H47N3/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-21-15-26-20(17-31-27(30)32-26)16-29(21,5)25(22)13-14-28(23,24)4/h17-19,21-25H,6-16H2,1-5H3,(H2,30,31,32)/t19-,21+,22+,23-,24+,25+,28-,29+/m1/s1 |
InChIKey | DFWTXQNFDUUGAR-XGRUNVPYSA-N |
Mol Weight | 437.7 g/mol |
Molecular Formula | C29H47N3 |
Exact Mass | 437.376999 g/mol |
SpectraBase Spectrum ID | Gsr0HnRNS1o |
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Name | 2'-Amino-5.alpha.-cholest-2-eno[3,2-d]pyrimidine |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C29H47N3 |
InChI | InChI=1S/C29H47N3/c1-18(2)7-6-8-19(3)23-11-12-24-22-10-9-21-15-26-20(17-31-27(30)32-26)16-29(21,5)25(22)13-14-28(23,24)4/h17-19,21-25H,6-16H2,1-5H3,(H2,30,31,32)/t19-,21+,22+,23-,24+,25+,28-,29+/m1/s1 |
InChIKey | DFWTXQNFDUUGAR-XGRUNVPYSA-N |
Molecular Weight | 437.716 g/mol |
SMILES | Nc1nc2C[C@]3([C@@]([C@@]4([C@@]([C@]5([C@]([C@]([C@@](CCCC(C)C)(C)[H])([H])CC5)(C)CC4)[H])([H])CC3)[H])(Cc2cn1)C)[H] |
SPLASH | splash10-0079-1310900000-c04feff759fe0ca7a91b |
Source of Spectrum | U-1995-894-5 |
Wiley ID | 766885 |