| SpectraBase Compound ID | F45yz1bWt2e |
|---|---|
| InChI | InChI=1S/C38H60O9/c1-21(2)10-9-11-23(33(44)47-34-32(43)31(42)30(41)27(20-39)46-34)24-14-18-38(8)26-12-13-28-35(4,5)29(45-22(3)40)16-17-36(28,6)25(26)15-19-37(24,38)7/h10,23-24,27-32,34,39,41-43H,9,11-20H2,1-8H3/t23-,24?,27?,28?,29-,30?,31?,32?,34?,36?,37?,38+/m1/s1 |
| InChIKey | LVGXQNCCBAHXHL-OKHWNJQZSA-N |
| Mol Weight | 660.9 g/mol |
| Molecular Formula | C38H60O9 |
| Exact Mass | 660.423734 g/mol |
Mass Spectrum (GC)
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| SpectraBase Spectrum ID | 4bUX6D58KX1 |
|---|---|
| Name | 3.alpha.-Acetoxy-5.alpha.-lanosta-8,24-dien-21-oic Acid - Ester - .beta.-D-glucoside |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C38H60O9 |
| InChI | InChI=1S/C38H60O9/c1-21(2)10-9-11-23(33(44)47-34-32(43)31(42)30(41)27(20-39)46-34)24-14-18-38(8)26-12-13-28-35(4,5)29(45-22(3)40)16-17-36(28,6)25(26)15-19-37(24,38)7/h10,23-24,27-32,34,39,41-43H,9,11-20H2,1-8H3/t23-,24?,27?,28?,29-,30?,31?,32?,34?,36?,37?,38+/m1/s1 |
| InChIKey | LVGXQNCCBAHXHL-OKHWNJQZSA-N |
| Molecular Weight | 660.889 g/mol |
| SMILES | OC1C(C(CO)OC(C1O)OC([C@@](C1C2([C@](C3=C(C4(CC[C@](C(C4CC3)(C)C)(OC(=O)C)[H])C)CC2)(CC1)C)C)(CCC=C(C)C)[H])=O)O |
| SPLASH | splash10-0006-8010921000-34fd41554dc650730781 |
| Source of Spectrum | G4-61-486-1 |
| Wiley ID | 1607160 |