(23S,24E)-23-Hydroxydammara-20,24-diene-3,26-dione

(23S,24E)-23-Hydroxydammara-20,24-diene-3,26-dione

Common Name: (23S,24E)-23-Hydroxydammara-20,24-diene-3,26-dione

Synonyms: (23S,24E)-23-Hydroxydammara-20,24-diene-3,26-dione

CAS Registry Number:

InChI: InChI=1S/C30H46O3/c1-19(18-31)16-21(32)17-20(2)22-10-14-29(6)23(22)8-9-25-28(5)13-12-26(33)27(3,4)24(28)11-15-30(25,29)7/h16,18,21-25,32H,2,8-15,17H2,1,3-7H3/b19-16+/t21-,22-,23-,24+,25-,28+,29-,30-/m1/s1

InChIKey: InChIKey=KUSJNVJEIABOSC-KYTXSLQASA-N

Formula: C30H46O3

Molecular Weight: 454.685566

Exact Mass: 454.344695

NMR Solvent: CDCl3

MHz:

Calibration:

NMR references: 13C - Chavez, H., Estevez-Braun, A., Ravelo, A.G., Gonzalez, A.G. Tetrahedron (1997) 53, 6465-72

Species:

Notes: Family : Terpenoids, Type : Triterpenoids, Group : Dammaranes; 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) 39.89
2 (CH2) 34.06
3 (C) 218.08
4 (C) 47.83
5 (CH) 55.28
6 (CH2) 19.58
7 (CH2) 34.63
8 (C) 40.31
9 (CH) 50.1
10 (C) 36.85
11 (CH2) 21.77
12 (CH2) 24.98
13 (CH) 45.2
14 (C) 49.43
15 (CH2) 31.32
16 (CH2) 29.05
17 (CH) 47.38
18 (CH3) 15.78
19 (CH3) 15.31
20 (C) 147.91
21 (CH2) 112.34
22 (CH2) 41.72
23 (CH) 66.66
24 (CH) 153.94
25 (C) 138.64
26 (CH) 194.93
27 (CH3) 9.72
28 (CH3) 26.68
29 (CH3) 20.99
30 (CH3) 16.02