Vitas-M small molecule compound

N-(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)-6-({6-[(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)carbamoyl]-2-({(6aR,6bS,8aS,11S,14bS)-11-[(2,4-dioxo-1,2,3,4-tetrahydropyrimidin-5-yl)carbamoyl]-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-1,2,3,4,4a,5,6,6a,6b,

Catalog ID
STL581438
SMILES O=c1[nH]cc(c(=O)[nH]1)NC(=O)C1OC(OC2CC[C@]3(C(C2(C)C)CC[C@@]2(C3C(=O)C=C3[C@@]2(C)CC[C@@]2(C3C[C@](C)(CC2)C(=O)Nc2c[nH]c(=O)[nH]c2=O)C)C)C)C(C(C1O)O)OC1OC(C(=O)Nc2c[nH]c(=O)[nH]c2=O)C(C(C1O)O)O

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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 C54H71N9O19 MW 1150.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C54H71N9O19/c1-49(2)27-8-11-54(7)37(26(64)16-21-22-17-51(4,13-12-50(22,3)14-15-53(21,54)6)45(75)60-25-20-57-48(78)63-40(25)72)52(27,5)10-9-28(49)79-44-36(32(68)31(67)35(81-44)42(74)59-24-19-56-47(77)62-39(24)71)82-43-33(69)29(65)30(66)34(80-43)41
InChIKey
NUDZMMFUJYJWCT-RYRFIQEGSA-N
Synonyms

N(24dioxo1234tetrahydropyrimidin5yl)6((6((24dioxo1234tetrahydropyrimidin5yl)carbamoyl)2(((6aR6bS8aS11S14bS)11((24dioxo1234tetrahydropyrimidin5yl)carbamoyl)446a6b8a1114bheptamethyl14oxo12344a566a6b
O=c1(nH)cc(c(=O)(nH)1)NC(=O)C1OC(OC2CC(C@)3(C(C2(C)C)CC(C@@)2(C3C(=O)C=C3(C@@)2(C)CC(C@@)2(C3C(C@)(C)(CC2)C(=O)Nc2c(nH)c(=O)(nH)c2=O)C)C)C)C(C(C1O)O)OC1OC(C(=O)Nc2c(nH)c(=O)(nH)c2=O)C(C(C1O)O)O

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Available files

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