Vitas-M small molecule compound
(7S,10Z)-7-(acetylamino)-10-{[3-(3,4-dihydroquinolin-1(2H)-yl)propyl]iminio}-1,2,3-trimethoxy-5,6,7,10-tetrahydrobenzo[a]heptalen-9-olate
Catalog ID
STL528490
SMILES COc1c2c(CC[C@@H](c3c2cc/c(=[NH+]/CCCN2CCCc4c2cccc4)/c(c3)[O-])NC(=O)C)cc(c1OC)OC
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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 C33H39N3O5 MW 557.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H39N3O5/c1-21(37)35-26-14-12-23-19-30(39-2)32(40-3)33(41-4)31(23)24-13-15-27(29(38)20-25(24)26)34-16-8-18-36-17-7-10-22-9-5-6-11-28(22)36/h5-6,9,11,13,15,19-20,26H,7-8,10,12,14,16-18H2,1-4H3,(H,34,38)(H,35,37)/t26-/m0/s1InChIKey
HTUSNSCXTYFYCL-SANMLTNESA-NSynonyms
1212465-19-4(7S10Z)7(acetylamino)10((3(34dihydroquinolin1(2H)yl)propyl)iminio)123trimethoxy56710tetrahydrobenzo(a)heptalen9olate
~(N)((7~(S))10(3(34dihydro2~(H)quinolin1yl)propylamino)123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen7yl)acetamide
1212465194
6563541
InChI=1SC33H39N3O5c121(37)35261412231930(392)32(403)33(414)31(23)24131527(29(38)2025(24)26)34168183617710229561128(22)36h569111315192026H781012141618H214H3(H3438)(H3537)t26m0s1
N((7S)10(3(34DIHYDRO2HQUINOLIN1YL)PROPYLAMINO)123TRIMETHOXY9OXO67DIHYDRO5HBENZO(A)HEPTALEN7YL)ACETAMIDE
ZINC000070669912
ZINC70669912
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