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. Author manuscript; available in PMC: 2014 Aug 16.
Published in final edited form as: Org Lett. 2013 Aug 5;15(16):4050–4053. doi: 10.1021/ol401396u

Table 1.

NMR spectroscopic data for pitinoic acid A (1) and pitinoic acid B (2) in CDCl3 (δ in ppm, J in Hz) at 600 MHz

C/H no. pitinoic acid A (1) pitinoic acid B (2)
δC δH(J) HMBCa δC δH(J) HMBCa
1 180.1 2, 3 173.3 2, 3
2 33.6 2.35 t (7.4) 3, 4 33.4 2.40 dt (7.8, 6.7) 3, 4
3 22.5 1.77 m 2, 4 22.7 1.79 m 2, 4
4 35.0 2.06 t (7.5) 3, 6, 11 35.2 2.06 t (7.3) 2, 3, 6, 11
5 148.7 3, 4, 6, 7, 11 148.9 3, 4, 6, 7, 11
6 35.6 1.99 t (7.5) 4, 7, 11 35.8 1.99 t (7.6) 4, 7, 11
7 27.3 1.42 m 6, 8 27.4 1.42 m 6, 8
8 31.6 1.26 m 7, 9, 10 31.7 1.26 m 6, 7, 9, 10
9 22.4 1.31 m 7, 8, 10 22.6 1.32 m 8, 10
10 13.9 0.89 t (7.1) 8, 9 14.1 0.89 t (7.1) 8, 9
11 109.5 4.72 s, 4.75 s 4, 6 109.8 4.72 s, 4.75 s 4, 6
1′ 173.5 2′
2′ 70.7 5.09 t (5.6) 3′, 4′, 5′
3′ 32.5 2.64 m 2′, 4′, 5′
4′ 127.3 5.9 m 2′, 3′, 5′
5′ 121.4 6.12 d (13.4) 3′, 4′
a

Protons showing long-range correlation to indicated carbon.