Common Name: 7β,19-Dihydroxy-14-methoxy-18(4->3)abeo-abieta-3,8,11,13-tetraen-18-oic acid lactone
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C21H26O4/c1-11(2)12-5-6-15-18(19(12)24-4)17(22)9-16-14-10-25-20(23)13(14)7-8-21(15,16)3/h5-6,11,16-17,22H,7-10H2,1-4H3/t16-,17-,21+/m0/s1
InChIKey: InChIKey=OMQCFSSTPCOICJ-XGHQBKJUSA-N
Formula: C21H26O4
Molecular Weight: 342.42874
Exact Mass: 342.183109
NMR Solvent: CDCl3
MHz: 400 (1H), 50 (13C)
Calibration: TMS
NMR references: 1H - Kutney J.P. and Han K. (1996) Studies with plant-cell cultures of the Chinese herbal plant, Tripterygium wilfordii. Recl. Trav. Chim. Pays-Bas 115, 77-93.
Species: Tripterygium wilfordii - Kutney J.P. and Han K. (1996) Studies with plant-cell cultures of the Chinese herbal plant, Tripterygium wilfordii. Recl. Trav. Chim. Pays-Bas 115, 77-93;
Notes: No 13C data provided.
Position | PPM | Peak Type | J (Hz) |
---|---|---|---|
1a | 1.65 | m | |
1b | 2.4 | m | |
2a | 2.4 | m | |
2b | 2.4 | m | |
5 | 2.72 | d | 14 |
6a | 2.4 | m | |
6b | 1.93 | ddd | 14, 13, 9 |
7a | 5.25 | dd | 9, 9 |
11 | 7.12 | d | 8.4 |
12 | 7.2 | d | 8.4 |
14-OCH3 | 3.83 | s | |
15 | 3.27 | sept | 6.9 |
16 | 1.18 | d | 6.9 |
17 | 1.27 | d | 6.9 |
19 | 4.77 | m | |
20 | 1.1 | s |