4,10-Didehydroxy-7-hydroxydeacetyldihydrobotrydial-1(10),5(9)-diene

4,10-Didehydroxy-7-hydroxydeacetyldihydrobotrydial-1(10),5(9)-diene

Common Name: 4,10-Didehydroxy-7-hydroxydeacetyldihydrobotrydial-1(10),5(9)-diene

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C15H22O2/c1-9-5-6-11-12-10(9)7-17-8-15(12,4)13(16)14(11,2)3/h7,9,13,16H,5-6,8H2,1-4H3/t9-,13-,15-/m1/s1

InChIKey: InChIKey=FMUFYIFXWSUYSC-XXLQHYSLSA-N

Formula: C15H22O2

Molecular Weight: 234.334545

Exact Mass: 234.16198

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Krohn, K., Dai, J., Florke, U., Aust, H.J., Drager, S., Schulz, B. J Nat Prod (2005) 68, 400-5

Species:

Notes: Family : Terpenoids, Type : Sesquiterpenoids, Group : Botryanes; 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 (C) 115.5
2 (CH) 29
3 (CH2) 33.2
4 (CH2) 20.5
5 (C) 130.6
6 (C) 42.5
7 (CH) 85.4
8 (C) 47.6
9 (C) 135.8
10 (CH) 135.6
11 (CH3) 17.9
12 (CH3) 21.2
13 (CH3) 26.4
14 (CH3) 15.8
15 (CH2) 77.6