1,15-Valparadien-3β-ol

1,15-Valparadien-3β-ol

Common Name: 1,15-Valparadien-3β-ol

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C20H32O/c1-14(2)15-6-11-20(5)16(15)7-9-18(3)12-13-19(4,21)10-8-17(18)20/h12-13,15-17,21H,1,6-11H2,2-5H3/t15-,16+,17+,18+,19+,20+/m0/s1

InChIKey: InChIKey=RKCZDGJPJJXXLC-RFVXBFLTSA-N

Formula: C20H32O1

Molecular Weight: 288.468227

Exact Mass: 288.245316

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Urones, J.G., Marcos, I.S., Basabe, P., Alonso, C., Oliva, I.M., Garrido, N.M., Martin, D.D., Lithgow, A.M. Tetrahedron (1993) 34, 4051-62

Species:

Notes: Family : Terpenoids, Type : Diterpenoids, Group : Valparanes; 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)

Carbon NMR Peaks

Position PPM
1 (CH) 130.9
2 (CH) 138.2
3 (C) 71
4 (CH2) 38.8
5 (CH2) 23.3
6 (CH) 56.8
7 (C) 46.6
8 (CH) 51
9 (CH2) 21.9
10 (CH2) 46.2
11 (C) 40.4
12 (CH2) 42.7
13 (CH2) 27.5
14 (CH) 49.3
15 (C) 148
16 (CH2) 110.2
17 (CH3) 25.8
18 (CH3) 17.4
19 (CH3) 28.9
20 (CH3) 21.8