| SpectraBase Compound ID | E2EtDkq1dzt |
|---|---|
| InChI | InChI=1S/C30H46O3/c1-25(2)14-16-30(24(32)33)17-15-28(6)19(20(30)18-25)8-9-22-27(5)12-11-23(31)26(3,4)21(27)10-13-29(22,28)7/h18-19,21-22H,8-17H2,1-7H3,(H,32,33)/t19-,21?,22-,27+,28-,29-,30+/m1/s1 |
| InChIKey | UMYJVVZWBKIXQQ-CLYAZYHMSA-N |
| Mol Weight | 454.7 g/mol |
| Molecular Formula | C30H46O3 |
| Exact Mass | 454.344695 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 | LUKuEkYKVe8 |
|---|---|
| Name | Moronic acid |
| CAS Registry Number | 6713-27-5 |
| Copyright | Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula | C30H46O3 |
| InChI | InChI=1S/C30H46O3/c1-25(2)14-16-30(24(32)33)17-15-28(6)19(20(30)18-25)8-9-22-27(5)12-11-23(31)26(3,4)21(27)10-13-29(22,28)7/h18-19,21-22H,8-17H2,1-7H3,(H,32,33)/t19-,21?,22-,27+,28-,29-,30+/m1/s1 |
| InChIKey | UMYJVVZWBKIXQQ-CLYAZYHMSA-N |
| Molecular Weight | 454.695 g/mol |
| SMILES | OC([C@]12C([C@@]3([C@]([C@@]4(CCC5[C@@]([C@]4(CC3)[H])(CCC(=O)C5(C)C)C)C)(CC1)C)[H])=CC(CC2)(C)C)=O |
| SPLASH | splash10-067m-8920000000-aa4af0cff30d8384a1f1 |
| Source of Spectrum | J-44-2812-0 |
| Synonyms | 3-Oxoolean-18-en-28-oic acid (4aS,6aR,6aR,6bR,12aR,14aS)-2,2,6a,6b,9,9,12a-heptamethyl-10-oxo-4,5,6,6a,7,8,8a,11,12,13,14,14a-dodecahydro-3H-picene-4a-carboxylic acid (4aS,6aR,6aR,6bR,12aR,14aS)-2,2,6a,6b,9,9,12a-heptamethyl-10-oxidanylidene-4,5,6,6a,7,8,8a,11,12,13,14,14a-dodecahydro-3H-picene-4a-carboxylic acid |
| Wiley ID | 1388900 |