| SpectraBase Compound ID | G8G8JeXyPiO |
|---|---|
| InChI | InChI=1S/C30H46O5/c1-26(2)22(32)10-13-28(4)18-7-8-20-27(3,16-17(18)15-19(31)24(26)28)12-9-21-29(20,5)14-11-23(33)30(21,6)25(34)35/h15,18,20-24,32-33H,7-14,16H2,1-6H3,(H,34,35)/t18-,20-,21+,22+,23+,24-,27-,28+,29+,30+/m0/s1 |
| InChIKey | PZUQEBIOBVCCSP-LPBYFKGCSA-N |
| Mol Weight | 486.7 g/mol |
| Molecular Formula | C30H46O5 |
| Exact Mass | 486.334525 g/mol |
Mass Spectrum (GC)
View the Full Spectrum for FREE!
The full spectrum can only be viewed using a FREE account.
| SpectraBase Spectrum ID | JnmM1w9Kp6z |
|---|---|
| Name | 16-Oxo-3.alpha.,21.beta.-dihydroxyserrat-14-en-24-oic acid |
| Appearance | White powder |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H46O5 |
| InChI | InChI=1S/C30H46O5/c1-26(2)22(32)10-13-28(4)18-7-8-20-27(3,16-17(18)15-19(31)24(26)28)12-9-21-29(20,5)14-11-23(33)30(21,6)25(34)35/h15,18,20-24,32-33H,7-14,16H2,1-6H3,(H,34,35)/t18-,20-,21+,22+,23+,24-,27-,28+,29+,30+/m0/s1 |
| InChIKey | PZUQEBIOBVCCSP-LPBYFKGCSA-N |
| Instrument Name | MAT-95 |
| Ionization Type | EI |
| Literature Reference DOI | 10.1021/np0301590 |
| Molecular Weight | 486.693 g/mol |
| Optical Rotation | [a]D20 = +10.5 (c = 0.55, C5D5N) |
| Reported Formula | C30H46O5 |
| SMILES | O[C@@]1(CC[C@]2([C@]([C@]1(C(O)=O)C)(CC[C@@]1([C@@]2(CC[C@]2(C(C1)=CC([C@@]1([C@@]2(CC[C@](C1(C)C)(O)[H])C)[H])=O)[H])[H])C)[H])C)[H] |
| SPLASH | splash10-00ri-0921400000-00f26c7385e9d09ac1fe |
| Source of Spectrum | G4-66-1331-6 |
| Wiley ID | 1883881 |