diosgenin 3-O-beta-D-glucoside (CHEBI:74020)

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CHEBI:74020 - diosgenin 3-O-β-D-glucoside

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ChEBI ID	CHEBI:74020
ChEBI Name	diosgenin 3-O-β-D-glucoside
Stars
ASCII Name	diosgenin 3-O-beta-D-glucoside
Definition	A sterol 3-β-D-glucoside having diosgenin as the sterol component.
Last Modified	4 December 2020
Submitter	KAX
Downloads	Molfile

Formula	C33H52O8
Net Charge	0
Average Mass	576.771
Monoisotopic Mass	576.36622
SMILES	[H][C@@]12CC=C3C[C@@H](O[C@@H]4O[C@H](CO)[C@@H](O)[C@H](O)[C@H]4O)CC[C@]3(C)[C@@]1([H])CC[C@@]1(C)[C@@]2([H])C[C@]2([H])O[C@]3(CC[C@@H](C)CO3)[C@@H](C)[C@]12[H]
InChI	InChI=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
InChIKey	WXMARHKAXWRNDM-GAMIEDRGSA-N

Roles Classification

Biological Roles:

metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.

metabolite Any intermediate or product resulting from metabolism. The term 'metabolite' subsumes the classes commonly known as primary and secondary metabolites.

ChEBI Ontology

Outgoing Relation(s)
	diosgenin 3-O-β-D-glucoside (CHEBI:74020) has functional parent diosgenin (CHEBI:4629)
	diosgenin 3-O-β-D-glucoside (CHEBI:74020) has parent hydride spirostan (CHEBI:26745)
	diosgenin 3-O-β-D-glucoside (CHEBI:74020) has role metabolite (CHEBI:25212)
	diosgenin 3-O-β-D-glucoside (CHEBI:74020) is a hexacyclic triterpenoid (CHEBI:70994)
	diosgenin 3-O-β-D-glucoside (CHEBI:74020) is a monosaccharide derivative (CHEBI:63367)
	diosgenin 3-O-β-D-glucoside (CHEBI:74020) is a spiroketal (CHEBI:72600)
	diosgenin 3-O-β-D-glucoside (CHEBI:74020) is a sterol 3-β-D-glucoside (CHEBI:37424)

IUPAC Name
(25R)-spirost-5-en-3β-yl β-D-glucopyranoside

INNs	Source
disogluside	ChemIDplus
disoglusido	ChemIDplus
disoglusidum	ChemIDplus

Synonyms	Source
(25R)-spirost-5-en-3β-ol 3-O-β-D-glucopyranoside	LIPID MAPS
(25R)-3beta-(beta-D-Glucopyranosyloxy)spirost-5-ene	ChemIDplus
3-O-(Glcβ)-(25R)-spirost-5en-3β-ol	LIPID MAPS
(3β,25R)-spirost-5-en-3-yl β-D-glucopyranoside	IUPAC
collettiside I	LIPID MAPS
diosgenin 3-β-D-glucoside	ChEBI

UniProt Name	Source
diosgenin 3-O-β-D-glucoside	UniProt

Manual Xrefs	Databases
HMDB0029310	HMDB
LMST01080092	LIPID MAPS

Registry Numbers	Sources
Reaxys:70308	Reaxys
CAS:14144-06-0	ChemIDplus

Citations