Vitas-M small molecule compound
beta-hydroxy-N-[({[(3E,8xi,9xi,14xi,17xi)-20-oxopregn-4-en-3-ylidene]amino}oxy)acetyl]phenylalanine
Catalog ID
STL004113
SMILES O=C(NC(C(c1ccccc1)O)C(=O)O)CO/N=C/1\CC[C@]2(C(=C1)CCC1C2CC[C@]2(C1CCC2C(=O)C)C)C
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 C32H42N2O6 MW 550.70 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H42N2O6/c1-19(35)24-11-12-25-23-10-9-21-17-22(13-15-31(21,2)26(23)14-16-32(24,25)3)34-40-18-27(36)33-28(30(38)39)29(37)20-7-5-4-6-8-20/h4-8,17,23-26,28-29,37H,9-16,18H2,1-3H3,(H,33,36)(H,38,39)/b34-22+/t23?,24?,25?,26?,28?,29?,31-,32+/m0/s1InChIKey
QMTROCXDTJEAQE-KDJAGYIGSA-NSynonyms
2((2((E)((10R13S)17acetyl1013dimethyl126789111214151617dodecahydrocyclopenta(a)phenanthren3ylidene)amino)oxyacetyl)amino)3hydroxy3phenylpropanoicacid
2(2((((10R13S)17acetyl1013dimethyl78911121314151617decahydro1Hcyclopenta(a)phenanthren3(2H6H10H)ylidene)amino)oxy)acetamido)3hydroxy3phenylpropanoicacid
BETAHYDROXYN(((((3E8XI9XI14XI17XI)20OXOPREGN4EN3YLIDENE)AMINO)OXY)ACETYL)PHENYLALANINE
CC(=O)C1CCC2C1(CCC3C2CCC4=CC(=NOCC(=O)NC(C(C5=CC=CC=C5)O)C(=O)O)CCC34C)C
InChI=1SC32H42N2O6c119(35)2411122523109211722(131531(212)26(23)141632(2425)3)34401827(36)3328(30(38)39)29(37)207546820h48172326282937H91618H213H3(H3336)(H3839)b3422+t23?24?25?26?28?29?3132+m0s1
MFCD04146887
O=C(NC(C(c1ccccc1)O)C(=O)O)CON=C1CC(C@)2(C(=C1)CCC1C2CC(C@)2(C1CCC2C(=O)C)C)C
ZINC000253503533
ZINC000253503541
Check stock
See real-time availability and sample size for STL004113 on the Vitas-M platform.
Check stock on Vitas-MAvailable files
Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.