VITAS-M Laboratory logo VITAS‑M Laboratory COMPOUNDS FOR BIOLOGICAL SCREENING
AND LEAD OPTIMIZATION
Vitas-M small molecule compound

N-(4-oxo-4-{[(5aS,6R,8aS,9R,10S,12R,12aR)-3,6,9-trimethyldecahydro-3,12-epoxy[1,2]dioxepino[4,3-i]isochromen-10-yl]oxy}butanoyl)phenylalanine

Catalog ID
STL553264
SMILES O=C(NC(C(=O)O)Cc1ccccc1)CCC(=O)O[C@@H]1O[C@@H]2O[C@]3(C)CC[C@@H]4C2([C@H]([C@H]1C)CC[C@H]4C)OO3

Contact us by email for worldwide delivery information, pricing, and real‑time availability. Send us your quotation request, and we will confirm stock levels, provide exact costs and lead times, suggest alternatives or find analogs when helpful, and share any additional specifications you may need.

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 C28H37NO9 MW 531.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H37NO9/c1-16-9-10-20-17(2)25(35-26-28(20)19(16)13-14-27(3,36-26)37-38-28)34-23(31)12-11-22(30)29-21(24(32)33)15-18-7-5-4-6-8-18/h4-8,16-17,19-21,25-26H,9-15H2,1-3H3,(H,29,30)(H,32,33)/t16-,17-,19+,20+,21?,25-,26-,27?,28?/m1/s1
InChIKey
TVNRJHJCDOMWKB-FDUAUGRGSA-N
Synonyms

16402810
2((4oxo4(((4~(S)5~(R)8~(S)9~(R)10~(S)12~(R))159trimethyl11141516tetraoxatetracyclo(10310^(413)0^(813))hexadecan10yl)oxy)butanoyl)amino)3phenylpropanoicacid
2(4oxo4(((3R5aS6R8aS9R10S12R12aR)369trimethyldecahydro3H312epoxy(12)dioxepino(43i)isochromen10yl)oxy)butanamido)3phenylpropanoicacid
InChI=1SC28H37NO9c1169102017(2)25(352628(20)19(16)131427(33626)373828)3423(31)121122(30)2921(24(32)33)15187546818h48161719212526H915H213H3(H2930)(H3233)t161719+20+21?252627?28?m1s1
N(4oxo4(((5aS6R8aS9R10S12R12aR)369trimethyldecahydro312epoxy(12)dioxepino(43i)isochromen10yl)oxy)butanoyl)phenylalanine
O=C(NC(C(=O)O)Cc1ccccc1)CCC(=O)O(C@@H)1O(C@@H)2OC3(C)CC(C@@H)4C2((C@H)((C@H)1C)CC(C@H)4C)OO3
ZINC000100769898
ZINC000106362058

Check stock

See real-time availability and sample size for STL553264 on the Vitas-M platform.

Check stock on Vitas-M

Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.

Download SDF Download MOL 3D structure Download SDS