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

3-(1,3-benzodioxol-5-yl)-3-[(3S,11E)-14,16-dihydroxy-3-methyl-1,7-dioxo-3,4,5,6,7,8,9,10-octahydro-1H-2-benzoxacyclotetradecin-15-yl]-N-[(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-9-yl)methyl]propanamide

Catalog ID
STL561599
SMILES COc1c2CN(C)CCc2c(c2c1OCO2)CNC(=O)CC(c1c(O)cc2c(c1O)C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/2)c1ccc2c(c1)OCO2

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 C41H46N2O11 MW 742.82 g/mol Purity >90% as per NMR
InChI
InChI=1S/C41H46N2O11/c1-23-8-7-11-26(44)10-6-4-5-9-25-16-31(45)36(37(47)35(25)41(48)54-23)28(24-12-13-32-33(17-24)51-21-50-32)18-34(46)42-19-29-27-14-15-43(2)20-30(27)38(49-3)40-39(29)52-22-53-40/h5,9,12-13,16-17,23,28,45,47H,4,6-8,10-11,14-15,18-22H2,1-3
InChIKey
JLLJMWVCZAWBAA-YYSZGFLBSA-N
Synonyms

145704956
3(13benzodioxol5yl)3((3S11E)1416dihydroxy3methyl17dioxo345678910octahydro1H2benzoxacyclotetradecin15yl)N((4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin9yl)methyl)propanamide
3(13benzodioxol5yl)3((4S12E)1618dihydroxy4methyl28dioxo3oxabicyclo(1240)octadeca1(18)121416tetraen17yl)N((4methoxy6methyl78dihydro5H(13)dioxolo(45g)isoquinolin9yl)methyl)propanamide
3(benzo(d)(13)dioxol5yl)3((SE)1416dihydroxy3methyl17dioxo345678910octahydro1Hbenzo(c)(1)oxacyclotetradecin15yl)N((4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin9yl)methyl)propanamide
COc1c2CN(C)CCc2c(c2c1OCO2)CNC(=O)CC(c1c(O)cc2c(c1O)C(=O)O(C@@H)(C)CCCC(=O)CCCC=C2)c1ccc2c(c1)OCO2
InChI=1SC41H46N2O11c123871126(44)106459251631(45)36(37(47)35(25)41(48)5423)28(2412133233(1724)51215032)1834(46)42192927141543(2)2030(27)38(493)4039(29)52225340h591213161723284547H468101114151822H213H3(H4246)b95+t2328?m0s1
MFCD32650664
NOLIN9YL)METHYL)PROPANAMIDE
ZINC001848442788
ZINC001848442789

Check stock

See real-time availability and sample size for STL561599 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