Vitas-M small molecule compound

(7S)-N-[(2S)-1-{[2-(cyclohex-1-en-1-yl)ethyl]amino}-3-methyl-1-oxobutan-2-yl]-5-oxo-7,8,13,13b-tetrahydro-5H-benzo[1,2]indolizino[8,7-b]indole-7-carboxamide

Catalog ID
STL533354
SMILES CC([C@@H](C(=O)NCCC1=CCCCC1)NC(=O)[C@@H]1Cc2c(C3N1C(=O)c1c3cccc1)[nH]c1c2cccc1)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 C32H36N4O3 MW 524.66 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H36N4O3/c1-19(2)27(31(38)33-17-16-20-10-4-3-5-11-20)35-30(37)26-18-24-21-12-8-9-15-25(21)34-28(24)29-22-13-6-7-14-23(22)32(39)36(26)29/h6-10,12-15,19,26-27,29,34H,3-5,11,16-18H2,1-2H3,(H,33,38)(H,35,37)/t26-,27-,29?/m0/s1
InChIKey
XVJPMPHGNKHRLK-DARYULOESA-N
Synonyms
956818-55-6
(11~(S))~(N)((2~(S))1(2(cyclohexen1yl)ethylamino)3methyl1oxobutan2yl)9oxo1020diazapentacyclo(11700^(210)0^(38)0^(1419))icosa1(13)357141618heptaene11carboxamide
(7S)N((2S)1((2(cyclohex1en1yl)ethyl)amino)3methyl1oxobutan2yl)5oxo781313btetrahydro5Hbenzo(12)indolizino(87b)indole7carboxamide
(7S)N((S)1((2(cyclohex1en1yl)ethyl)amino)3methyl1oxobutan2yl)5oxo781313btetrahydro5Hbenzo(12)indolizino(87b)indole7carboxamide
16403965
956818556
CC((C@@H)(C(=O)NCCC1=CCCCC1)NC(=O)(C@@H)1Cc2c(C3N1C(=O)c1c3cccc1)(nH)c1c2cccc1)C
InChI=1SC32H36N4O3c119(2)27(31(38)33171620104351120)3530(37)2618242112891525(21)3428(24)292213671423(22)32(39)36(26)29h61012151926272934H35111618H212H3(H3338)(H3537)t262729?m0s1
MFCD07636911
ZINC000015959723
ZINC000070699743

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Available files

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