Vitas-M small molecule compound

2-oxo-4-propyl-2H-chromen-7-yl beta-D-glucopyranoside

Catalog ID
STL460046
SMILES CCCc1cc(=O)oc2c1ccc(c2)O[C@@H]1O[C@H](CO)[C@H]([C@@H]([C@H]1O)O)O

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C18H22O8 MW 366.37 g/mol Purity >90% as per NMR
InChI
InChI=1S/C18H22O8/c1-2-3-9-6-14(20)25-12-7-10(4-5-11(9)12)24-18-17(23)16(22)15(21)13(8-19)26-18/h4-7,13,15-19,21-23H,2-3,8H2,1H3/t13-,15-,16+,17-,18-/m1/s1
InChIKey
IGYUYWDDVAWVPJ-SOVHRIKKSA-N
Synonyms
124617-97-6
124617976
2oxo4propyl2Hchromen7ylbetaDglucopyranoside
4propyl7(((2S3R4S5S6R)345trihydroxy6(hydroxymethyl)tetrahydro2Hpyran2yl)oxy)2Hchromen2one
4PROPYL7((2S3R4S5S6R)345TRIHYDROXY6(HYDROXYMETHYL)OXAN2YL)OXYCHROMEN2ONE
CCCC1=CC(=O)OC2=C1C=CC(=C2)OC3C(C(C(C(O3)CO)O)O)O
CCCc1cc(=O)oc2c1ccc(c2)O(C@@H)1O(C@H)(CO)(C@H)((C@@H)((C@H)1O)O)O
InChI=1SC18H22O8c1239614(20)2512710(4511(9)12)241817(23)16(22)15(21)13(819)2618h471315192123H238H21H3t131516+1718m1s1
MFCD05671509
ZINC000004073459
ZINC04073459
ZINC4073459

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Available files

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