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Chikusetsusaponin-V

MNXM103742 is deprecated and here replaced by MNXM726178
!!! Alternative mappings exist !!!

Properties

Image

Occurences in reactions

MNX_ID

MNXM726178

	#reac
in my sandbox	0
in MNXref (generic)	1
in models (compartimentalized)	0

formula

C₄₈H₇₆O₁₉

charge

mass

956.49808

reference

chebi:67981

InChIKey

NFZYDZXHKFHPGA-QQHDHSITSA-N

InChI

InChI=1S/C48H76O19/c1-43(2)14-16-48(42(61)67-40-35(58)31(54)29(52)24(20-50)63-40)17-15-46(6)21(22(48)18-43)8-9-26-45(5)12-11-27(44(3,4)25(45)10-13-47(26,46)7)64-41-37(33(56)32(55)36(65-41)38(59)60)66-39-34(57)30(53)28(51)23(19-49)62-39/h8,22-37,39-41,49-58H,9-20H2,1-7H3,(H,59,60)/t22-,23+,24+,25-,26+,27-,28+,29+,30-,31-,32-,33-,34+,35+,36-,37+,39-,40-,41+,45-,46+,47+,48-/m0/s1

SMILES

CC1(C)CC[C@]2(C(=O)O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)CC[C@]3(C)C(=CC[C@@H]4[C@@]5(C)CC[C@H](O[C@@H]6O[C@H](C(=O)O)[C@@H](O)[C@H](O)[C@H]6O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)C(C)(C)[C@@H]5CC[C@]43C)[C@@H]2C1

Parent-child relations graph

Deprecated MNXref IDs graph

Similar chemical compounds in external resources
Identifier	Description
CHEBI:67981 chebi:67981	Chikusetsusaponin-V Ginsenoside Ro beta-D-Glucopyranosiduronic acid, (3beta)-28-(beta-D-glucopyranosyloxy)-28-oxoolean-12-en-3-yl 2-O-beta-D-glucopyranosyl-
kegg.compound:C17543 keggC:C17543	Chikusetsusaponin V Ginsenoside Ro
seed.compound:cpd17668 seedM:cpd17668	Ginsenoside Ro Chikusetsusaponin V ginsenoside Ro
metacyc.compound:CPD-15576 metacycM:CPD-15576	ginsenoside Ro
keggC:M_C17543 seedM:M_cpd17668	secondary/obsolete/fantasy identifier