input word = C00057356

Metabolite InformationStructural formula
Name Notoginsenoside T2
Formula C37H62O10
Mw 666.4342982
CAS RN 343962-54-9
C_ID C00057356
InChIKey UWWGFPDRXDYTKI-BEZNHFNHSA-N
InChICode InChI=1S/C37H62O10/c1-18(14-21(44-9)31-34(4,5)47-31)19-10-13-36(7)26(19)20(39)15-24-35(6)12-11-25(40)33(2,3)30(35)22(16-37(24,36)8)45-32-29(43)28(42)27(41)23(17-38)46-32/h14,19-32,38-43H,10-13,15-17H2,1-9H3/b18-14+/t19-,20-,21?,22+,23-,24-,25+,26+,27-,28+,29-,30+,31?,32-,35-,36-,37-/m1/s1
SMILES CC([C@@H](O)CC[C@@]1([C@@]2([H])C[C@@H](O)[C@]3([H])[C@@H](/C(C)=C/C(OC)C4C(C)(C)O4)CC[C@]35C)C)([C@]1([H])[C@@H](O[C@H]6[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O6)C[C@]25C)C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAraliaceaePanax notoginseng Ref.
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