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(20S)-ginsenoside C-K

MNXM146284 is deprecated and here replaced by MNXM1368176
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM1368176 Image of MNXM1368176
referencechebi:77146
formulaC36H62O8
global charge0
mol weight622.884
InChIKeyFVIZARNDLVOMSU-IRFFNABBSA-N
InChIInChI=1S/C36H62O8/c1-20(2)10-9-14-36(8,44-31-30(42)29(41)28(40)23(19-37)43-31)21-11-16-35(7)27(21)22(38)18-25-33(5)15-13-26(39)32(3,4)24(33)12-17-34(25,35)6/h10,21-31,37-42H,9,11-19H2,1-8H3/t21-,22+,23+,24-,25+,26-,27-,28+,29-,30+,31-,33-,34+,35+,36-/m0/s1
SMILESCC(C)=CCC[C@](C)(O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)[C@H]1CC[C@]2(C)[C@@H]1[C@H](O)C[C@@H]1[C@@]3(C)CC[C@H](O)C(C)(C)[C@@H]3CC[C@]12C
MNX internals
InChI (mnx)InChI=1/C36H62O8/c1-20(2)10-9-14-36(8,44-31-30(42)29(41)28(40)23(19-37)43-31)21-11-16-35(7)27(21)22(38)18-25-33(5)15-13-26(39)32(3,4)24(33)12-17-34(25,35)6/h10,21-31,37-42H,9,11-19H2,1-8H3/t21-,22+,23+,24-,25+,26-,27-,28+,29-,30+,31-,33-,34+,35+,36-/m0/s1 Image of MNXM1368176
SMILES (mnx)[CH3:1][C:20]([CH3:2])=[CH:10][CH2:9][CH2:14][C@@:36]([CH3:8])([C@H:21]1[CH2:11][CH2:16][C@:35]2([CH3:7])[C@@H:27]1[C@H:22]([OH:38])[CH2:18][C@@H:25]1[C@@:33]3([CH3:5])[CH2:15][CH2:13][C@H:26]([OH:39])[C:32]([CH3:3])([CH3:4])[C@@H:24]3[CH2:12][CH2:17][C@:34]12[CH3:6])[O:44][C@H:31]1[C@H:30]([OH:42])[C@@H:29]([OH:41])[C@H:28]([OH:40])[C@@H:23]([CH2:19][OH:37])[O:43]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)6
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:77146
chebi:77146
FVIZARNDLVOMSU-IRFFNABBSA-N 		(20S)-ginsenoside C-K
(3beta,12beta)-3,12-dihydroxydammar-24-en-20-yl beta-D-glucopyranoside
20beta-(beta-D-glucopyranosyloxy)dammar-24-ene-3beta,12beta-diol
ginsenoside C-K
ginsenoside compound K

kegg.compound:C22127
keggC:C22127
FVIZARNDLVOMSU-IRFFNABBSA-N 		Ginsenoside C-K

metacyc.compound:CPD-15450
metacycM:CPD-15450
FVIZARNDLVOMSU-IRFFNABBSA-N 		ginsenoside C-K
(3beta,12beta)-3,12-dihydroxydammar-24-en-20-yl beta-D-glucopyranoside
20-(beta-D-glucopyranosyloxy)dammar-24-ene-3beta,12-diol
compound K

keggC:M_C22127 		secondary/obsolete/fantasy identifier