| SpectraBase Spectrum ID |
9rmlCVdPxUV |
| Name |
17-Norkaurane-18-d-13-carboxylic acid, 3-oxo-, methyl ester, (4.alpha.,8.beta.,13.beta.)- |
| Alternate Name(s) |
1H-2,10a-ethanophenanthrene, 17-norkaurane-18-D-13-carboxylic acid deriv.
Methyl ester of ent-3-oxo(19-2H)beyeran-17-oic acid |
| CAS Registry Number |
82053-79-0 |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C21H31DO3 |
| InChI |
InChI=1S/C21H32O3/c1-18(2)14-5-9-20-11-12-21(13-20,17(23)24-4)10-6-15(20)19(14,3)8-7-16(18)22/h14-15H,5-13H2,1-4H3/t14?,15?,19-,20+,21-/m0/s1/i1D/t14?,15?,18-,19+,20-,21+/m1 |
| InChIKey |
YWXFEPCZCHNEEZ-FHYDIEHYSA-N |
| Molecular Weight |
333.490 g/mol |
| SMILES |
[C@@]12(C([C@](C)(C[2D])C(CC2)=O)CC[C@@]23C1CC[C@@](C(=O)OC)(C3)CC2)C |
| SPLASH |
splash10-0002-0092000000-01422a0564e71af62712 |
| Source of Spectrum |
B-35-620-0 |
| Wiley ID |
1329855 |
