Vitas-M small molecule compound

2-methyl-4-oxo-3-phenyl-4H-chromen-7-yl 3,4,6-tri-O-acetyl-2-(acetylamino)-2-deoxy-beta-D-glucopyranoside

Catalog ID
STL526346
SMILES CC(=O)OC[C@H]1O[C@@H](Oc2ccc3c(c2)oc(c(c3=O)c2ccccc2)C)[C@@H]([C@H]([C@@H]1OC(=O)C)OC(=O)C)NC(=O)C

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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 C30H31NO11 MW 581.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H31NO11/c1-15-25(20-9-7-6-8-10-20)27(36)22-12-11-21(13-23(22)38-15)41-30-26(31-16(2)32)29(40-19(5)35)28(39-18(4)34)24(42-30)14-37-17(3)33/h6-13,24,26,28-30H,14H2,1-5H3,(H,31,32)/t24-,26-,28-,29-,30-/m1/s1
InChIKey
GYXQEHNTUUSVMG-CXRHZIOTSA-N
Synonyms
388582-43-2
((2~(R)3~(S)4~(R)5~(R)6~(S))5acetamido34diacetyloxy6(2methyl4oxo3phenylchromen7yl)oxyoxan2yl)methylacetate
(2R3S4R5R6S)5acetamido2(acetoxymethyl)6((2methyl4oxo3phenyl4Hchromen7yl)oxy)tetrahydro2Hpyran34diyldiacetate
12044191
2methyl4oxo3phenyl4Hchromen7yl346triOacetyl2(acetylamino)2deoxybetaDglucopyranoside
388582432
CC(=O)OC(C@H)1O(C@@H)(Oc2ccc3c(c2)oc(c(c3=O)c2ccccc2)C)(C@@H)((C@H)((C@@H)1OC(=O)C)OC(=O)C)NC(=O)C
InChI=1SC30H31NO11c11525(2097681020)27(36)22121121(1323(22)3815)413026(3116(2)32)29(4019(5)35)28(3918(4)34)24(4230)143717(3)33h61324262830H14H215H3(H3132)t2426282930m1s1
MFCD02925106
ZINC000070670151
ZINC70670151

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.