input word = C00062942

Metabolite InformationStructural formula
Name Notoginsenoside T4
Formula C36H62O11
Mw 670.42921282
CAS RN 769188-38-7
C_ID C00062942
InChIKey CPOQFUOZMUPFIT-CCZMZTMISA-N
InChICode InChI=1S/C36H62O11/c1-31(2)23(39)10-12-33(5)22-15-19(38)25-18(36(8,45)14-11-24(40)32(3,4)44)9-13-34(25,6)35(22,7)16-20(29(31)33)46-30-28(43)27(42)26(41)21(17-37)47-30/h11,14,18-30,37-45H,9-10,12-13,15-17H2,1-8H3/b14-11+/t18-,19+,20-,21+,22+,23-,24+,25-,26+,27-,28+,29-,30+,33+,34+,35+,36-/m0/s1
SMILES CC(C)(O)C(O)C=CC(C)(O)C1CCC2(C)C1C(O)CC1C3(C)CCC(O)C(C)(C)C3C(OC3OC(CO)C(O)C(O)C3O)CC12C
Start Substs in Alk. Biosynthesis (Prediction)
Organism
Kingdom Family Species Reference
PlantaeAraliaceaePanax notoginseng Ref.
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