Vitas-M small molecule compound
4-{[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]amino}-N-(pyridin-2-yl)butanamide
Catalog ID
STL541610
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCCCC(=O)Nc2ccccn2)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 C30H34N4O6 MW 546.62 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H34N4O6/c1-18(35)33-22-12-10-19-16-25(38-2)29(39-3)30(40-4)28(19)20-11-13-23(24(36)17-21(20)22)31-15-7-9-27(37)34-26-8-5-6-14-32-26/h5-6,8,11,13-14,16-17,22H,7,9-10,12,15H2,1-4H3,(H,31,36)(H,33,35)(H,32,34,37)/t22-/m0/s1InChIKey
DXKNAVQPHKLHRG-QFIPXVFZSA-NSynonyms
1630923-23-7(S)4((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(pyridin2yl)butanamide
1630923237
4(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)pyridin2ylbutanamide
4(((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(pyridin2yl)butanamide
91637668
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NCCCC(=O)Nc2ccccn2)NC(=O)C)cc(c1OC)OC
InChI=1SC30H34N4O6c118(35)33221210191625(382)29(393)30(404)28(19)20111323(24(36)1721(20)22)31157927(37)3426856143226h568111314161722H79101215H214H3(H3136)(H3335)(H323437)t22m0s1
ZINC000217782587
ZINC217782587
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