SpectraBase Compound ID | 2kARHw0ACjk |
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InChI | InChI=1S/C29H48O/c1-6-20(24-16-18(24)2)15-19(3)25-9-10-26-23-8-7-21-17-22(30)11-13-28(21,4)27(23)12-14-29(25,26)5/h7,18-20,22-27,30H,6,8-17H2,1-5H3/t18-,19-,20-,22+,23+,24-,25-,26+,27+,28+,29-/m1/s1 |
InChIKey | AAJHVCTWRPOTGA-LNCSDJNBSA-N |
Mol Weight | 412.7 g/mol |
Molecular Formula | C29H48O |
Exact Mass | 412.370516 g/mol |
SpectraBase Spectrum ID | AHwwCo4JQOh |
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Name | Hebesterol |
CAS Registry Number | 114247-95-9 |
Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula | C29H48O |
InChI | InChI=1S/C29H48O/c1-6-20(24-16-18(24)2)15-19(3)25-9-10-26-23-8-7-21-17-22(30)11-13-28(21,4)27(23)12-14-29(25,26)5/h7,18-20,22-27,30H,6,8-17H2,1-5H3/t18-,19-,20-,22+,23+,24-,25-,26+,27+,28+,29-/m1/s1 |
InChIKey | AAJHVCTWRPOTGA-LNCSDJNBSA-N |
Molecular Weight | 412.702 g/mol |
SMILES | O[C@]1(CC[C@@]2([C@]3(CC[C@]4([C@]([C@@]3(CC=C2C1)[H])(CC[C@@]4([C@@](C[C@]([C@@]1(C[C@]1(C)[H])[H])(CC)[H])(C)[H])[H])[H])C)[H])C)[H] |
SPLASH | splash10-0h90-0093100000-5b9cd093b1f5c4d2a874 |
Source of Spectrum | KC-1987-1313-11 |
Wiley ID | 1374826 |