Vitas-M small molecule compound

(16Z,18E,28E)-5,6,21,23-tetrahydroxy-27-methoxy-2,4,11,16,20,22,24,26-octamethyl-1,15-dioxo-1,2-dihydro-2,7-(epoxypentadeca[1,11,13]trienoimino)furo[2'',3'':7',8']naphtho[1',2':4,5]imidazo[1,2-a]pyridin-25-yl acetate

Catalog ID
STL372936
SMILES COC1/C=C/OC2(C)Oc3c(C2=O)c2c(c(c3C)O)c(O)c(c3c2nc2n3ccc(c2)C)NC(=O)/C(=C\C=C\C(C(C(C(C(C(C1C)OC(=O)C)C)O)C)O)C)/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 C43H51N3O11 MW 785.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C43H51N3O11/c1-19-14-16-46-28(18-19)44-32-29-30-37(50)25(7)40-31(29)41(52)43(9,57-40)55-17-15-27(54-10)22(4)39(56-26(8)47)24(6)36(49)23(5)35(48)20(2)12-11-13-21(3)42(53)45-33(34(32)46)38(30)51/h11-18,20,22-24,27,35-36,39,48-51H,1-10H3,(H,45,53)/b
InChIKey
NZCRJKRKKOLAOJ-XWSQLESMSA-N
Synonyms

(16Z18E28E)562123tetrahydroxy27methoxy24111620222426octamethyl115dioxo12dihydro27(epoxypentadeca(11113)trienoimino)furo(2378)naphtho(1245)imidazo(12a)pyrid
CC1C=CC=C(C(=O)NC2=C(C3=C(C4=C(C(=C3O)C)OC(C4=O)(OC=CC(C(C(C(C(C(C1O)C)O)C)OC(=O)C)C)OC)C)C5=C2N6C=CC(=CC6=N5)C)O)C
COC1C=COC2(C)Oc3c(C2=O)c2c(c(c3C)O)c(O)c(c3c2nc2n3ccc(c2)C)NC(=O)C(=CC=CC(C(C(C(C(C(C1C)OC(=O)C)C)O)C)O)C)C
IN25YLACETATE
InChI=1SC43H51N3O11c11914164628(1819)4432293037(50)25(7)4031(29)41(52)43(95740)55171527(5410)22(4)39(5626(8)47)24(6)36(49)23(5)35(48)20(2)12111321(3)42(53)4533(34(32)46)38(30)51h1118202224273536394851H110H3(H4553)b1211+1715+2113
MFCD28142999
ZINC000253370223
ZINC000254704316

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Available files

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