Vitas-M small molecule compound
(S)-(3aR,5R,6S,6aR)-5-((R)-2,2-dimethyl-1,3-dioxolan-4-yl)-2,2-dimethyltetrahydrofuro[2,3-d][1,3]dioxol-6-yl 2-(((benzyloxy)carbonyl)amino)-4-methylpentanoate
Catalog ID
STL526864
SMILES CC(C[C@@H](C(=O)OC1C2OC(OC2O[C@@H]1[C@@H]1COC(O1)(C)C)(C)C)NC(=O)OCc1ccccc1)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 C26H37NO9 MW 507.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H37NO9/c1-15(2)12-17(27-24(29)30-13-16-10-8-7-9-11-16)22(28)32-20-19(18-14-31-25(3,4)34-18)33-23-21(20)35-26(5,6)36-23/h7-11,15,17-21,23H,12-14H2,1-6H3,(H,27,29)/t17-,18+,19+,20?,21?,23?/m0/s1InChIKey
YNIFGNHTUBRHLX-UASPOOGDSA-NSynonyms
(S)(3aR5R6S6aR)5((R)22dimethyl13dioxolan4yl)22dimethyltetrahydrofuro(23d)(13)dioxol6yl2(((benzyloxy)carbonyl)amino)4methylpentanoate
CC(C(C@@H)(C(=O)OC1C2OC(OC2O(C@@H)1(C@@H)1COC(O1)(C)C)(C)C)NC(=O)OCc1ccccc1)C
InChI=1SC26H37NO9c115(2)1217(2724(29)301316108791116)22(28)322019(18143125(34)3418)332321(20)3526(56)3623h71115172123H1214H216H3(H2729)t1718+19+20?21?23?m0s1
ZINC000008964498
ZINC000012660615
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