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cholesteryl-alpha-D-glucoside

MNXM153440 is deprecated and here replaced by MNXM729575
!!! Alternative mappings exist !!!
PropertiesImage
MNX_IDMNXM729575 Image of MNXM729575
referencemetacycM:CPD-19682
formulaC33H56O6
global charge0
mol weight548.805
InChIKeyFSMCJUNYLQOAIM-HUAQYVKVSA-N
InChIInChI=1S/C33H56O6/c1-19(2)7-6-8-20(3)24-11-12-25-23-10-9-21-17-22(13-15-32(21,4)26(23)14-16-33(24,25)5)38-31-30(37)29(36)28(35)27(18-34)39-31/h9,19-20,22-31,34-37H,6-8,10-18H2,1-5H3/t20-,22+,23+,24-,25+,26+,27-,28-,29+,30-,31+,32+,33-/m1/s1
SMILESCC(C)CCC[C@@H](C)[C@H]1CC[C@H]2[C@@H]3CC=C4C[C@@H](O[C@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)CC[C@]4(C)[C@H]3CC[C@]12C
MNX internals
InChI (mnx)InChI=1/C33H56O6/c1-19(2)7-6-8-20(3)24-11-12-25-23-10-9-21-17-22(13-15-32(21,4)26(23)14-16-33(24,25)5)38-31-30(37)29(36)28(35)27(18-34)39-31/h9,19-20,22-31,34-37H,6-8,10-18H2,1-5H3/t20-,22+,23+,24-,25+,26+,27-,28-,29+,30-,31+,32+,33-/m1/s1 Image of MNXM729575
SMILES (mnx)[CH3:1][CH:19]([CH3:2])[CH2:7][CH2:6][CH2:8][C@@H:20]([CH3:3])[C@H:24]1[CH2:11][CH2:12][C@H:25]2[C@@H:23]3[CH2:10][CH:9]=[C:21]4[CH2:17][C@@H:22]([O:38][C@@H:31]5[C@H:30]([OH:37])[C@@H:29]([OH:36])[C@H:28]([OH:35])[C@@H:27]([CH2:18][OH:34])[O:39]5)[CH2:13][CH2:15][C@:32]4([CH3:4])[C@H:26]3[CH2:14][CH2:16][C@:33]12[CH3:5]
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)1
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

metacyc.compound:CPD-19682
metacycM:CPD-19682
FSMCJUNYLQOAIM-HUAQYVKVSA-N 		cholesteryl-alpha-D-glucoside
(3beta)-cholest-5-en-3-yl-alpha-D-glucopyranoside
O-alpha-D-glucosyl-cholesterol
cholesterol alpha-D-glucoside

seed.compound:cpd31775
seedM:cpd31775
FSMCJUNYLQOAIM-HUAQYVKVSA-N 		(3beta)-cholest-5-en-3-yl-alpha-D-glucopyranoside
O-alpha-D-glucosyl-cholesterol
cholesterol alpha-D-glucoside
cholesteryl-alpha-D-glucoside

lipidmaps:LMST05050029
lipidmapsM:LMST05050029
FSMCJUNYLQOAIM-HUAQYVKVSA-N 		Cholesteryl-alpha-D-glucoside
(3beta)-cholest-5-en-3-yl D-glucopyranoside
Cholest-5-en-3beta-yl alpha-D-glucopyranoside
Cholesterol glucoside
Cholesteryl glucoside
Cholesteryl-alpha-D-glucoside
Hex
O
ST 27:1
cholesteryl-alpha-D-glucopyranside

seedM:M_cpd31775 		secondary/obsolete/fantasy identifier