Triptocallic acid C

Triptocallic acid C

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)

Carbon NMR Peaks

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