Common Name: Triptocallic acid C
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C30H48O4/c1-24(2)21(31)9-8-18-27(5)13-15-29(7)20-17-26(4,23(32)33)11-10-25(20,3)12-14-28(29,6)19(27)16-22-30(18,24)34-22/h18-22,31H,8-17H2,1-7H3,(H,32,33)/t18-,19-,20+,21-,22+,25+,26+,27-,28+,29-,30-/m0/s1
InChIKey: InChIKey=ICXWWEDNOSYVIP-FOACAYPJSA-N
Formula: C30H48O4
Molecular Weight: 472.700853
Exact Mass: 472.35526
NMR Solvent: C5D5N
MHz:
Calibration:
NMR references: 13C - Nakano, K., Oose, Y., Takaishi, Y. Phytochemistry (1997) 46, 1179-82
Species:
Notes: Family : Terpenoids, Type : Triterpenoids, Group : Glutinanes; 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) | 18.3 |
2 (CH2) | 30.3 |
3 (CH) | 76 |
4 (C) | 39.1 |
5 (C) | 64.9 |
6 (CH) | 52.2 |
7 (CH2) | 21.9 |
8 (CH) | 45.1 |
9 (C) | 35.1 |
10 (CH) | 49.3 |
11 (CH2) | 35.3 |
12 (CH2) | 29.4 |
13 (C) | 39.6 |
14 (C) | 39.3 |
15 (CH2) | 29.3 |
16 (CH2) | 36.8 |
17 (C) | 30.6 |
18 (CH) | 45 |
19 (CH2) | 30.7 |
20 (C) | 40.7 |
21 (CH2) | 30.5 |
22 (CH2) | 36.9 |
23 (CH3) | 25.4 |
24 (CH3) | 20.9 |
25 (CH3) | 18.3 |
26 (CH3) | 15.9 |
27 (CH3) | 17.8 |
28 (CH3) | 31.9 |
29 (C) | 182.7 |
30 (CH3) | 32.8 |