Vitas-M small molecule compound

N~2~-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-[2-(morpholin-4-yl)ethyl]-L-alaninamide

Catalog ID
STL544338
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)N[C@H](C(=O)NCCN2CCOCC2)C)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 C30H40N4O7 MW 568.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H40N4O7/c1-18(30(37)31-10-11-34-12-14-41-15-13-34)32-24-9-7-21-22(17-25(24)36)23(33-19(2)35)8-6-20-16-26(38-3)28(39-4)29(40-5)27(20)21/h7,9,16-18,23H,6,8,10-15H2,1-5H3,(H,31,37)(H,32,36)(H,33,35)/t18-,23-/m0/s1
InChIKey
ZLKPFXAQRBVVST-MBSDFSHPSA-N
Synonyms

(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(2morpholin4ylethyl)propanamide
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(2morpholinoethyl)propanamide
100000139
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)N(C@H)(C(=O)NCCN2CCOCC2)C)NC(=O)C)cc(c1OC)OC
InChI=1SC30H40N4O7c118(30(37)31101134121441151334)3224972122(1725(24)36)23(3319(2)35)86201626(383)28(394)29(405)27(20)21h79161823H681015H215H3(H3137)(H3236)(H3335)t1823m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(2(morpholin4yl)ethyl)Lalaninamide
ZINC000218000309
ZINC218000309

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Available files

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