| SpectraBase Compound ID | KLMwQbj2WwH |
|---|---|
| InChI | InChI=1S/C30H44O5/c1-25(2)11-12-29(24(34)35)13-14-30(17-31)18(19(29)16-25)15-20(32)23-27(5)9-8-22(33)26(3,4)21(27)7-10-28(23,30)6/h15,19,21,23,31H,7-14,16-17H2,1-6H3,(H,34,35)/t19-,21?,23-,27+,28-,29+,30+/m1/s1 |
| InChIKey | CANQRFJVTLMMPC-CQFSTFKJSA-N |
| Mol Weight | 484.7 g/mol |
| Molecular Formula | C30H44O5 |
| Exact Mass | 484.318875 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 | 1SQ6mLnBHmp |
|---|---|
| Name | 27-Hydroxy-3,11-dioxoolean-12-en-28-oic acid |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H44O5 |
| InChI | InChI=1S/C30H44O5/c1-25(2)11-12-29(24(34)35)13-14-30(17-31)18(19(29)16-25)15-20(32)23-27(5)9-8-22(33)26(3,4)21(27)7-10-28(23,30)6/h15,19,21,23,31H,7-14,16-17H2,1-6H3,(H,34,35)/t19-,21?,23-,27+,28-,29+,30+/m1/s1 |
| InChIKey | CANQRFJVTLMMPC-CQFSTFKJSA-N |
| Molecular Weight | 484.677 g/mol |
| SMILES | OC([C@]12[C@@](C3=CC([C@@]4([C@@]5(C(CC[C@]4([C@]3(CO)CC1)C)C(C(CC5)=O)(C)C)C)[H])=O)(CC(CC2)(C)C)[H])=O |
| SPLASH | splash10-0udi-0000900000-2b9803bb2d797c611dc8 |
| Source of Spectrum | E1-46-513-6 |
| Synonyms | (18alpha)-27-hydroxy-3,11-dioxoolean-12-en-28-oic acid |
| Wiley ID | 1554279 |