Systematic / IUPAC Name: (3β,12β)-20-{[6-O-(β-D-Glucopyranosyl)-β-D-glucopyranosyl]oxy}-12-hydroxydammar-24-en-3-yl 2-O-β-D-glucopyranosyl-β-D-glucopyranoside
ID: Reference6128
Other Names:
20(S)-Ginsenoside Rb1 ;
Ginsenoside-Rb1;
GRb 1;
GS-Rb1;
Gynosaponin C
; more
Formula: C54H92O23
Class: Endogenous Metabolites Natural Products/Medicines
Ginsenoside Rb1 mass spectral data can be found in a separate interface. The data are manually curated and of the highest quality.
Used Instruments | Orbitrap Elite |
No. of Spectral Trees | 1 |
No. of Spectra | 208 |
Tandem Spectra | MS1, MS2 |
Ionization Methods | NSI |
Analyzers | IT; FT |
Last Modification | 12/12/2016 8:29:13 AM |
InChI | InChI=1S/C54H92O23/c1-23(2)10-9-14-54(8,77-48-44(69)40(65)37(62)29(74-48)22-70-46-42(67)38(63)34(59)26(19-55)71-46)24-11-16-53(7)33(24)25(58)18-31-51(5)15-13-32(50(3,4)30(51)12-17-52(31,53)6)75-49-45(41(66)36(61)28(21-57)73-49)76-47-43(68)39(64)35(60)27(20-56)72-47/h10,24-49,55-69H,9,11-22H2,1-8H3/t24-,25+,26+,27+,28+,29+,30-,31+,32-,33-,34+,35+,36+,37+,38-,39-,40-,41-,42+,43+,44+,45+,46+,47-,48-,49-,51-,52+,53+,54-/m0/s1 |
InChI Key | GZYPWOGIYAIIPV-JBDTYSNRSA-N |
Canonical SMILES | CC(=CCCC(C)(C1CCC2(C1C(CC3C2(CCC4C3(CCC(C4(C)C)OC5C(C(C(C(O5)CO)O)O)OC6C(C(C(C(O6)CO)O)O)O)C)C)O)C)OC7C(C(C(C(O7)COC8C(C(C(C(O8)CO)O)O)O)O)O)O)C |
CAS | 41753439 |
Splash | |
Other Names |
20(S)-Ginsenoside Rb1 ; Ginsenoside-Rb1; GRb 1; GS-Rb1; Gynosaponin C; Gypenoside III; Panax saponin E ; Pseudoginsenoside D; Sanchinoside E1 ; (3β,12β)-20-[(6-O-β-D-Glucopyranosyl-β-D-glucopyranosyl)oxy]-12-hydroxydammar-24-en-3-yl 2-O-β-D-glucopyranosyl-β-D-glucopyranoside; 2-O-β-Glucopyranosyl-(3β,12β)-20-[(6-O-β-D-glucopyranosyl-β-D-glucopyranosyl)oxy]-12-hydroxydammar-24-en-3-yl-β-D-glucopyranoside ; NSC 310103 |
ChEMBL | CHEMBL501515 |
KEGG | C20713 |
ChEBI | CHEBI:67989 |
PubChem | 9898279 |
ChemSpider | 8073937 |