Common Name: (1E,3S,5S)-1,7-Diphenyl-1-heptene-3,5-diol
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C19H22O2/c20-18(13-11-16-7-3-1-4-8-16)15-19(21)14-12-17-9-5-2-6-10-17/h1-11,13,18-21H,12,14-15H2/b13-11+/t18-,19+/m0/s1
InChIKey: InChIKey=YSRHCYXKOMRFPK-VJKINUSGSA-N
Formula: C19H22O2
Molecular Weight: 282.377488
Exact Mass: 282.16198
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Ngo, K.S., Brown, G.D. Phytochemistry (1998) 47, 1117-23
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Labdanes; 13 C Spectrum from Naproc 13: José Luis López-Pérez, Roberto Therón, Esther del Olmo, David Díaz: NAPROC-13: a database for the dereplication of natural product mixtures in bioassay-guided protocols. Bioinformatics 23(23):3256-3257 (2007)
Position | PPM |
---|---|
1 (CH2) | 31.12 |
2 (CH2) | 39.7 |
3 (CH) | 70.69 |
4 (CH2) | 43.38 |
5 (CH) | 73.76 |
6 (CH) | 131.85 |
7 (CH) | 130.19 |
1' (C) | 141.89 |
2' (CH) | 128.62 |
3' (CH) | 128.47 |
4' (CH) | 125.92 |
5' (CH) | 128.47 |
6' (CH) | 128.62 |
1'' (C) | 136.5 |
2'' (CH) | 126.52 |
3'' (CH) | 128.44 |
4'' (CH) | 127.81 |
5'' (CH) | 128.44 |
6'' (CH) | 126.52 |