Vitas-M small molecule compound
N-{[(3-benzyl-4,8,8-trimethyl-2-oxo-9,10-dihydro-2H,8H-pyrano[2,3-f]chromen-5-yl)oxy]acetyl}-L-alanine
Catalog ID
STL534753
SMILES O=C(N[C@H](C(=O)O)C)COc1cc2OC(C)(C)CCc2c2c1c(C)c(c(=O)o2)Cc1ccccc1
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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 C27H29NO7 MW 479.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29NO7/c1-15-19(12-17-8-6-5-7-9-17)26(32)34-24-18-10-11-27(3,4)35-20(18)13-21(23(15)24)33-14-22(29)28-16(2)25(30)31/h5-9,13,16H,10-12,14H2,1-4H3,(H,28,29)(H,30,31)/t16-/m0/s1InChIKey
LIAVUWVLJVCJHA-INIZCTEOSA-NSynonyms
956965-73-4(2~(S))2((2((3benzyl488trimethyl2oxo910dihydropyrano(23h)chromen5yl)oxy)acetyl)amino)propanoicacid
(S)2(2((3benzyl488trimethyl2oxo28910tetrahydropyrano(23f)chromen5yl)oxy)acetamido)propanoicacid
16407097
956965734
InChI=1SC27H29NO7c11519(12178657917)26(32)342418101127(34)3520(18)1321(23(15)24)331422(29)2816(2)25(30)31h591316H101214H214H3(H2829)(H3031)t16m0s1
N(((3benzyl488trimethyl2oxo910dihydro2H8Hpyrano(23f)chromen5yl)oxy)acetyl)Lalanine
O=C(N(C@H)(C(=O)O)C)COc1cc2OC(C)(C)CCc2c2c1c(C)c(c(=O)o2)Cc1ccccc1
ZINC000008877976
ZINC8877976
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