| SpectraBase Spectrum ID |
FuxFCU9mtkF |
| Name |
Methyl ent-12.beta.- Acetoxy-17-oxokaur-15-en-19-oate |
| Appearance |
Colorless plates |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C23H32O5 |
| InChI |
InChI=1S/C23H32O5/c1-14(25)28-17-10-19-21(2)7-5-8-22(3,20(26)27-4)18(21)6-9-23(19)11-15(13-24)16(17)12-23/h11,13,16-19H,5-10,12H2,1-4H3/t16-,17+,18+,19+,21-,22-,23-/m1/s1 |
| InChIKey |
QXNVDWGXUGYHNS-WJPQBGAJSA-N |
| Instrument Name |
Hewlett-Packard 5973 |
| Ionization Type |
EI positive ion |
| Literature Reference DOI |
10.1021/np030490j |
| Molecular Weight |
388.504 g/mol |
| Optical Rotation |
[a]D20 = -39.6 (c = 0.723, CHCl3) |
| SMILES |
C1C[C@@]2([C@@](CC[C@@]34[C@@]2([H])C[C@](OC(C)=O)([C@](C4)(C(=C3)C=O)[H])[H])([H])[C@](C)(C(OC)=O)C1)C |
| SPLASH |
splash10-0603-1921000000-1fc753a366caed54e21b |
| Source of Spectrum |
G4-67-620-19 |
| Wiley ID |
1881743 |
