input word = C00060449

Metabolite InformationStructural formula
Name Notoginsenoside SP5
Formula C36H62O11
Mw 670.42921282
CAS RN 1801723-25-0
C_ID C00060449
InChIKey SFQVTNVBDMIAAA-LTTVORMPSA-N
InChICode InChI=1S/C36H62O11/c1-17(13-20(39)30(44)33(4,5)45)18-9-12-35(7)25(18)19(38)14-23-34(6)11-10-24(40)32(2,3)29(34)21(15-36(23,35)8)46-31-28(43)27(42)26(41)22(16-37)47-31/h13,18-31,37-45H,9-12,14-16H2,1-8H3/b17-13+/t18-,19-,20+,21+,22-,23-,24+,25+,26-,27+,28-,29+,30-,31-,34-,35-,36-/m1/s1
SMILES CC(=CC(O)C(O)C(C)(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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