Vitas-M small molecule compound

(7S)-5-oxo-N-[(2S)-1-oxo-1-{[3-(propan-2-yloxy)propyl]amino}propan-2-yl]-7,8,13,13b-tetrahydro-5H-benzo[1,2]indolizino[8,7-b]indole-7-carboxamide

Catalog ID
STL533291
SMILES CC(OCCCNC(=O)[C@@H](NC(=O)[C@@H]1Cc2c(C3N1C(=O)c1c3cccc1)[nH]c1c2cccc1)C)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 C28H32N4O4 MW 488.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H32N4O4/c1-16(2)36-14-8-13-29-26(33)17(3)30-27(34)23-15-21-18-9-6-7-12-22(18)31-24(21)25-19-10-4-5-11-20(19)28(35)32(23)25/h4-7,9-12,16-17,23,25,31H,8,13-15H2,1-3H3,(H,29,33)(H,30,34)/t17-,23-,25?/m0/s1
InChIKey
CJPOILWVIULFMZ-WBOWKOBNSA-N
Synonyms
956997-47-0
(11~(S))9oxo~(N)((2~(S))1oxo1(3propan2yloxypropylamino)propan2yl)1020diazapentacyclo(11700^(210)0^(38)0^(1419))icosa1(13)357141618heptaene11carboxamide
(7S)5oxoN((2S)1oxo1((3(propan2yloxy)propyl)amino)propan2yl)781313btetrahydro5Hbenzo(12)indolizino(87b)indole7carboxamide
(7S)N((S)1((3isopropoxypropyl)amino)1oxopropan2yl)5oxo781313btetrahydro5Hbenzo(12)indolizino(87b)indole7carboxamide
16405349
956997470
CC(OCCCNC(=O)(C@@H)(NC(=O)(C@@H)1Cc2c(C3N1C(=O)c1c3cccc1)(nH)c1c2cccc1)C)C
InChI=1SC28H32N4O4c116(2)36148132926(33)17(3)3027(34)231521189671222(18)3124(21)251910451120(19)28(35)32(23)25h479121617232531H81315H213H3(H2933)(H3034)t172325?m0s1
MFCD06770165
ZINC000008791599
ZINC000012887573

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Available files

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