Vitas-M small molecule compound

N~2~-{(1E)-1-[(9bR)-6-acetyl-7,9-dihydroxy-8,9b-dimethyl-1,3-dioxo-3,9b-dihydrodibenzo[b,d]furan-2(1H)-ylidene]ethyl}-N-(furan-2-ylmethyl)glycinamide

Catalog ID
STL548482
SMILES O=C(CN/C(=C/1\C(=O)C=C2[C@@](C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)/C)NCc1ccco1

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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 C25H24N2O8 MW 480.47 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H24N2O8/c1-11-21(31)19(13(3)28)23-20(22(11)32)25(4)16(35-23)8-15(29)18(24(25)33)12(2)26-10-17(30)27-9-14-6-5-7-34-14/h5-8,26,31-32H,9-10H2,1-4H3,(H,27,30)/b18-12+/t25-/m0/s1
InChIKey
XZSGHKDSPHMYFB-QAKGTIEWSA-N
Synonyms

(RE)2((1(6acetyl79dihydroxy89bdimethyl13dioxo19bdihydrodibenzo(bd)furan2(3H)ylidene)ethyl)amino)N(furan2ylmethyl)acetamide
110206732
2(((1~(E))1((9~(b)~(R))6acetyl79dihydroxy89~(b)dimethyl13dioxodibenzofuran2ylidene)ethyl)amino)~(N)(furan2ylmethyl)acetamide
InChI=1SC25H24N2O8c11121(31)19(13(3)28)2320(22(11)32)25(4)16(3523)815(29)18(24(25)33)12(2)261017(30)279146573414h58263132H910H214H3(H2730)b1812+t25m0s1
N~2~((1E)1((9bR)6acetyl79dihydroxy89bdimethyl13dioxo39bdihydrodibenzo(bd)furan2(1H)ylidene)ethyl)N(furan2ylmethyl)glycinamide
N2((1E)1((9BR)6ACETYL79DIHYDROXY89BDIMETHYL13DIOXO39BDIHYDRODIBENZO(BD)FURAN2(1H)YLIDENE)ETHYL)N(FURAN2YLMETHYL)GLYCINAMIDE
O=C(CNC(=C1C(=O)C=C2(C@@)(C1=O)(C)c1c(O)c(C)c(c(c1O2)C(=O)C)O)C)NCc1ccco1
ZINC000253414624
ZINC253414624

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Available files

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