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-cyclopropyl-L-leucinamide

Catalog ID
STL540691
SMILES COc1cc2CC[C@@H](c3c(c2c(c1OC)OC)ccc(c(=O)c3)N[C@H](C(=O)NC1CC1)CC(C)C)NC(=O)C

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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 C30H39N3O6 MW 537.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H39N3O6/c1-16(2)13-24(30(36)32-19-8-9-19)33-23-12-10-20-21(15-25(23)35)22(31-17(3)34)11-7-18-14-26(37-4)28(38-5)29(39-6)27(18)20/h10,12,14-16,19,22,24H,7-9,11,13H2,1-6H3,(H,31,34)(H,32,36)(H,33,35)/t22-,24-/m0/s1
InChIKey
AYWVEQHGNDLQJU-UPVQGACJSA-N
Synonyms
1574352-91-2
(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)cyclopropyl4methylpentanamide
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)Ncyclopropyl4methylpentanamide
1574352912
75492420
COc1cc2CC(C@@H)(c3c(c2c(c1OC)OC)ccc(c(=O)c3)N(C@H)(C(=O)NC1CC1)CC(C)C)NC(=O)C
InChI=1SC30H39N3O6c116(2)1324(30(36)32198919)332312102021(1525(23)35)22(3117(3)34)117181426(374)28(385)29(396)27(18)20h10121416192224H791113H216H3(H3134)(H3236)(H3335)t2224m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)NcyclopropylLleucinamide
ZINC000108451120
ZINC108451120

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Available files

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