Name |
Fenugreek saponin II |
Formula |
C38H62O12 |
Mw |
710.42412745 |
CAS RN |
1148111-51-6 |
C_ID |
C00056508
|
InChIKey |
OSHZDTNWJYPSSP-ZAJNYGSVSA-N |
InChICode |
InChI=1S/C38H62O12/c1-18-7-12-38(47-15-18)19(2)28-26(50-38)14-24-22-6-5-20-13-21(8-10-36(20,3)23(22)9-11-37(24,28)4)48-35-33(44)31(42)30(41)27(49-35)17-46-34-32(43)29(40)25(39)16-45-34/h18-35,39-44H,5-17H2,1-4H3/t18-,19-,20-,21-,22+,23-,24-,25+,26-,27+,28-,29-,30+,31-,32+,33+,34-,35+,36-,37-,38+/m0/s1 |
SMILES |
C[C@@]12[C@@]([H])(C[C@@]3([H])[C@]2([H])[C@H](C)[C@]4(OC[C@@H](C)CC4)O3)[C@]5([H])CC[C@@]6([H])C[C@@H](O[C@@H]7O[C@H](CO[C@@H]8OC[C@@H](O)[C@H](O)[C@H]8O)[C@@H](O)[C@H](O)[C@H]7O)CC[C@]6(C)[C@@]5([H])CC1 |
Start Substs in Alk. Biosynthesis (Prediction) |
|
Organism |
Kingdom |
Family |
Species |
Reference |
Plantae | Fabaceae | Trigonella foenum-graecum | Ref. |
|
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zoom in
Organism | Trigonella foenum-graecum | Reference | Aldrich Library of 13C and 1H FT NMR Spectra, 1992, 3, 564A (nmr) |
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