Search MNXref
 Feedback

diosgenin 3-O-beta-D-glucoside

PropertiesImage
MNX_IDMNXM1368618 Image of MNXM1368618
referencechebi:74020
formulaC33H52O8
global charge0
mol weight576.771
InChIKeyWXMARHKAXWRNDM-GAMIEDRGSA-N
InChIInChI=1S/C33H52O8/c1-17-7-12-33(38-16-17)18(2)26-24(41-33)14-23-21-6-5-19-13-20(8-10-31(19,3)22(21)9-11-32(23,26)4)39-30-29(37)28(36)27(35)25(15-34)40-30/h5,17-18,20-30,34-37H,6-16H2,1-4H3/t17-,18+,20+,21-,22+,23+,24+,25-,26+,27-,28+,29-,30-,31+,32+,33-/m1/s1
SMILESC[C@@H]1CC[C@@]2(OC1)O[C@H]1C[C@H]3[C@@H]4CC=C5C[C@@H](O[C@@H]6O[C@H](CO)[C@@H](O)[C@H](O)[C@H]6O)CC[C@]5(C)[C@H]4CC[C@]3(C)[C@H]1[C@@H]2C
MNX internals
InChI (mnx)InChI=1/C33H52O8/c1-17-7-12-33(38-16-17)18(2)26-24(41-33)14-23-21-6-5-19-13-20(8-10-31(19,3)22(21)9-11-32(23,26)4)39-30-29(37)28(36)27(35)25(15-34)40-30/h5,17-18,20-30,34-37H,6-16H2,1-4H3/t17-,18+,20+,21-,22+,23+,24+,25-,26+,27-,28+,29-,30-,31+,32+,33-/m1/s1 Image of MNXM1368618
SMILES (mnx)[CH3:1][C@@H:17]1[CH2:7][CH2:12][C@@:33]2([C@@H:18]([CH3:2])[C@H:26]3[C@H:24]([CH2:14][C@H:23]4[C@@H:21]5[CH2:6][CH:5]=[C:19]6[CH2:13][C@@H:20]([O:39][C@H:30]7[C@H:29]([OH:37])[C@@H:28]([OH:36])[C@H:27]([OH:35])[C@@H:25]([CH2:15][OH:34])[O:40]7)[CH2:8][CH2:10][C@:31]6([CH3:3])[C@H:22]5[CH2:9][CH2:11][C@@:32]43[CH3:4])[O:41]2)[O:38][CH2:16]1
Parent-child relations graph
Occurences in reactions#reac
in my sandbox 0
in MNXref (generic)2
in models (compartimentalized) 0
Similar chemical compounds in external resources
IdentifierDescription

CHEBI:74020
chebi:74020
WXMARHKAXWRNDM-GAMIEDRGSA-N 		diosgenin 3-O-beta-D-glucoside
(25R)-3beta-(beta-D-Glucopyranosyloxy)spirost-5-ene
(25R)-spirost-5-en-3beta-ol 3-O-beta-D-glucopyranoside
(25R)-spirost-5-en-3beta-yl beta-D-glucopyranoside
(3beta,25R)-spirost-5-en-3-yl beta-D-glucopyranoside
3-O-(Glcbeta)-(25R)-spirost-5en-3beta-ol
Diosgenin glucoside
collettiside I
diosgenin 3-beta-D-glucoside
disogluside
disoglusido
disoglusidum

metacyc.compound:CPD-15440
metacycM:CPD-15440
seed.compound:cpd32114
seedM:cpd32114
WXMARHKAXWRNDM-SDVGVXBASA-N 		3-O-beta-D-glucosyl-diosgenin

seed.compound:cpd31290
seedM:cpd31290
kegg.compound:C20709
keggC:C20709
WXMARHKAXWRNDM-GAMIEDRGSA-N 		Diosgenin 3-O-beta-D-glucopyranoside
(3beta,25R)-Spirost-5-en-3-ol 3-O-beta-D-glucopyranoside

lipidmaps:LMST01080094
lipidmapsM:LMST01080094
WXMARHKAXWRNDM-GAMIEDRGSA-N 		Trillin
(25R)-3B-(beta-D-Glucopyranosyloxy)spirost-5-ene
25R-Spirost-5-en-3beta-yl-beta-D-glucopyranoside
Alliumosid A
Collettiside I
Diosgenin glucoside
Disogluside
Funkioside A
Polygonatoside A, Lilioglycoside A, Melongoside B
Polyphyllin A
Prosapogenin D-3

keggC:M_C20709
seedM:M_cpd31290
seedM:M_cpd32114 		secondary/obsolete/fantasy identifier