Fornicatin B

Fornicatin B

Common Name: Fornicatin B

Synonyms:

CAS Registry Number:

InChI: InChI=1S/C27H40O6/c1-15(2)18-13-19(28)24-23(25(18,4)11-10-22(32)33)20(29)14-27(6)17(9-12-26(24,27)5)16(3)7-8-21(30)31/h16-19,28H,1,7-14H2,2-6H3,(H,30,31)(H,32,33)/t16-,17-,18+,19+,25+,26+,27-/m1/s1

InChIKey: InChIKey=YXVYBSGFMJBSQD-YDTNFRICSA-N

Formula: C27H40O6

Molecular Weight: 460.603929

Exact Mass: 460.282489

NMR Solvent: C5D5N

MHz:

Calibration:

NMR references: 13C - Niu, X.M., Qiu, M.H., Li, Z.R., Lu, Y., Cao, P., Zheng, Q.T. Tetrahedron Lett (2004) 45, 2989-93

Species:

Notes: Family : Terpenoids, Type : Triterpenoids, Group : Lanostanes; 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) 32.7
2 (CH2) 30.8
3 (C) 176.5
4 (C) 146.5
5 (CH) 45
6 (CH2) 35.5
7 (CH) 67.9
8 (C) 165.3
9 (C) 137.4
10 (C) 41.3
11 (C) 200.4
12 (CH2) 52.1
13 (C) 47.3
14 (C) 53.4
15 (CH2) 32.4
16 (CH2) 27.8
17 (CH) 50.1
18 (CH3) 17.7
19 (CH3) 22.4
20 (CH) 36.2
21 (CH3) 18.5
22 (CH2) 31.9
23 (CH2) 31.9
24 (C) 176.5
28 (CH2) 115.6
29 (CH3) 23.4
30 (CH3) 27.6