Common Name:

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C27H46O4/c1-21(15-19-31-25(30)10-7-5-6-8-18-28)11-13-23-22(20-29)12-14-24-26(2,3)16-9-17-27(23,24)4/h12,15,23-24,28-29H,5-11,13-14,16-20H2,1-4H3/b21-15+/t23-,24-,27+/m1/s1

InChIKey: InChIKey=CQEROZNKQGTEDC-DBLJEGBMSA-N

Formula: C27H46O4

Molecular Weight: 434.652764

Exact Mass: 434.33961

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Toki, M., Ooi, T., Kusumi, T. J Nat Prod (1999) 62, 1504-9

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)

Carbon NMR Peaks

Position PPM
1 (CH2) 39
2 (CH2) 18.7
3 (CH2) 42.1
4 (C) 32.9
5 (CH) 49.8
6 (CH2) 23.6
7 (CH) 125.5
8 (C) 139.2
9 (CH) 51.4
10 (C) 36.6
11 (CH2) 24.9
12 (CH2) 41
13 (C) 142.5
14 (CH) 119
15 (CH2) 61
16 (CH3) 16.5
17 (CH2) 65.8
18 (CH3) 21.7
19 (CH3) 33
20 (CH3) 13.5
15a (C) 173.8
15b (CH2) 29.3
15c (CH2) 29.2
15d (CH2) 25.6
15e (CH2) 29.3
15f (CH2) 29.4
15g (CH2) 62.9