Vitas-M small molecule compound
2-chloro-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-3-yl 2,3,4,6-tetra-O-acetylhexopyranoside
Catalog ID
STL466473
SMILES CC(=O)OCC1OC(Oc2cc3oc(=O)c4c(c3cc2Cl)CCCC4)C(C(C1OC(=O)C)OC(=O)C)OC(=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 C27H29ClO12 MW 580.97 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29ClO12/c1-12(29)34-11-22-23(35-13(2)30)24(36-14(3)31)25(37-15(4)32)27(40-22)39-21-10-20-18(9-19(21)28)16-7-5-6-8-17(16)26(33)38-20/h9-10,22-25,27H,5-8,11H2,1-4H3InChIKey
MSFMMJSYVUWAEJ-UHFFFAOYSA-NSynonyms
(2S3S4R5S6R)2(acetoxymethyl)6((2chloro6oxo78910tetrahydro6Hbenzo(c)chromen3yl)oxy)tetrahydro2Hpyran345triyltriacetate
(345triacetyloxy6((2chloro6oxo78910tetrahydrobenzo(c)chromen3yl)oxy)oxan2yl)methylacetate
2chloro6oxo78910tetrahydro6Hbenzo(c)chromen3yl2346tetraOacetylhexopyranoside
CC(=O)OC(C@@H)1O(C@@H)(Oc2cc3oc(=O)c4c(c3cc2Cl)CCCC4)(C@H)((C@@H)((C@H)1OC(=O)C)OC(=O)C)OC(=O)C
CC(=O)OCC1C(C(C(C(O1)OC2=C(C=C3C4=C(CCCC4)C(=O)OC3=C2)Cl)OC(=O)C)OC(=O)C)OC(=O)C
InChI=1SC27H29ClO12c112(29)34112223(3513(2)30)24(3614(3)31)25(3715(4)32)27(4022)3921102018(919(21)28)16756817(16)26(33)3820h910222527H5811H214H3
MFCD06764501
ZINC000070686773
ZINC000072332858
Check stock
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Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.