Vitas-M small molecule compound
4-methyl-2-{[3-methyl-2-({[(3aR,5S,5aR,8aS,8bR)-2,2,7,7-tetramethyltetrahydro-3aH-bis[1,3]dioxolo[4,5-b:4',5'-d]pyran-5-yl]carbonyl}amino)butanoyl]amino}pentanoic acid (non-preferred name)
Catalog ID
STL527710
SMILES CC(CC(C(=O)O)NC(=O)C(C(C)C)NC(=O)[C@H]1O[C@@H]2OC(O[C@@H]2[C@@H]2[C@H]1OC(O2)(C)C)(C)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 C23H38N2O9 MW 486.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H38N2O9/c1-10(2)9-12(20(28)29)24-18(26)13(11(3)4)25-19(27)16-14-15(32-22(5,6)31-14)17-21(30-16)34-23(7,8)33-17/h10-17,21H,9H2,1-8H3,(H,24,26)(H,25,27)(H,28,29)/t12?,13?,14-,15+,16+,17-,21-/m1/s1InChIKey
ZZHGKGQIPZGFLE-MHUIHLGLSA-NSynonyms
16398160
4methyl2((3methyl2((((3aR5S5aR8aS8bR)2277tetramethyltetrahydro3aHbis(13)dioxolo(45b45d)pyran5yl)carbonyl)amino)butanoyl)amino)pentanoicacid(nonpreferredname)
4methyl2((3methyl2(((1~(S)2~(R)6~(R)8~(S)9~(R))441111tetramethyl3571012pentaoxatricyclo(7300^(26))dodecane8carbonyl)amino)butanoyl)amino)pentanoicacid
4methyl2(3methyl2((3aR5S5aR8aS8bR)2277tetramethyltetrahydro3aHbis((13)dioxolo)(45b45d)pyran5carboxamido)butanamido)pentanoicacid
CC(CC(C(=O)O)NC(=O)C(C(C)C)NC(=O)(C@H)1O(C@@H)2OC(O(C@@H)2(C@@H)2(C@H)1OC(O2)(C)C)(C)C)C
InChI=1SC23H38N2O9c110(2)912(20(28)29)2418(26)13(11(3)4)2519(27)161415(3222(56)3114)1721(3016)3423(78)3317h101721H9H218H3(H2426)(H2527)(H2829)t12?13?1415+16+1721m1s1
MFCD03660680
ZINC000009007710
ZINC000012661539
Check stock
See real-time availability and sample size for STL527710 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.