Common Name: 5α,6α,10β-Trihydroxy-2α,14β-diacetoxy-taxadiene
Synonyms:
CAS Registry Number:
InChI: InChI=1S/C24H36O7/c1-11-8-17(30-13(3)25)20-22(31-14(4)26)19-12(2)21(29)16(28)10-24(19,7)9-15(27)18(11)23(20,5)6/h15-17,19-22,27-29H,2,8-10H2,1,3-7H3/t15-,16-,17-,19-,20-,21+,22-,24+/m0/s1
InChIKey: InChIKey=DWLOJMUIHHLMMW-QEYCLAGYSA-N
Formula: C24H36O7
Molecular Weight: 436.539363
Exact Mass: 436.246104
NMR Solvent: CDCl3
MHz:
Calibration:
NMR references: 13C - Hu, S.H., Tian, X.F., Zhu, W.H., Fang, Q.C. J Nat Prod (1996) 59, 1006-9
Species:
Notes: Family : Terpenoids, Type : Diterpenoids, Group : Taxanes; 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 (CH) | 59.07 |
2 (CH) | 70.6 |
3 (CH) | 40.91 |
4 (C) | 144.06 |
5 (CH) | 80.67 |
6 (CH) | 72.29 |
7 (CH2) | 40.03 |
8 (C) | 39.58 |
9 (CH2) | 47.44 |
10 (CH) | 67.56 |
11 (C) | 137.98 |
12 (C) | 133.64 |
13 (CH2) | 39.29 |
14 (CH) | 70.81 |
15 (C) | 37.54 |
16 (CH3) | 25.38 |
17 (CH3) | 32.22 |
18 (CH3) | 20.9 |
19 (CH3) | 25.38 |
20 (CH2) | 117.2 |
2a (C) | 169.86 |
2b (CH3) | 21.42 |
14a (C) | 169.86 |
14b (CH3) | 21.47 |