Vitas-M small molecule compound

3,4,8,10-tetrahydroxy-2-(hydroxymethyl)-9-methoxy-7-{[4-(2-phenoxyethyl)piperazin-1-yl]methyl}-3,4,4a,10b-tetrahydropyrano[3,2-c]isochromen-6(2H)-one

Catalog ID
STL496041
SMILES OCC1OC2C(C(C1O)O)OC(=O)c1c2c(O)c(c(c1CN1CCN(CC1)CCOc1ccccc1)O)OC

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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 C27H34N2O10 MW 546.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34N2O10/c1-36-25-20(31)16(13-29-9-7-28(8-10-29)11-12-37-15-5-3-2-4-6-15)18-19(22(25)33)24-26(39-27(18)35)23(34)21(32)17(14-30)38-24/h2-6,17,21,23-24,26,30-34H,7-14H2,1H3
InChIKey
GPPNFRHQOAAGBZ-UHFFFAOYSA-N
Synonyms

(2R3S4S4aR10bS)34810tetrahydroxy2(hydroxymethyl)9methoxy7((4(2phenoxyethyl)piperazin1yl)methyl)2344atetrahydropyrano(32c)isochromen6(10bH)one
34810tetrahydroxy2(hydroxymethyl)9methoxy7((4(2phenoxyethyl)piperazin1yl)methyl)344a10btetrahydropyrano(32c)isochromen6(2H)one
MFCD31751394
OC(C@H)1O(C@@H)2(C@@H)((C@H)((C@@H)1O)O)OC(=O)c1c2c(O)c(c(c1CN1CCN(CC1)CCOc1ccccc1)O)OC
ZINC000504793609
ZINC000504793620

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Available files

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