Vitas-M small molecule compound
(7S)-N-[(2S)-4-methyl-1-oxo-1-{[3-(propan-2-yloxy)propyl]amino}pentan-2-yl]-5-oxo-7,8,13,13b-tetrahydro-5H-benzo[1,2]indolizino[8,7-b]indole-7-carboxamide
Catalog ID
STL531874
SMILES CC(OCCCNC(=O)[C@@H](NC(=O)[C@@H]1Cc2c(C3N1C(=O)c1c3cccc1)[nH]c1c2cccc1)CC(C)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 C31H38N4O4 MW 530.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H38N4O4/c1-18(2)16-25(29(36)32-14-9-15-39-19(3)4)34-30(37)26-17-23-20-10-7-8-13-24(20)33-27(23)28-21-11-5-6-12-22(21)31(38)35(26)28/h5-8,10-13,18-19,25-26,28,33H,9,14-17H2,1-4H3,(H,32,36)(H,34,37)/t25-,26-,28?/m0/s1InChIKey
YOCQUNVBQPUVBG-QIELNMHASA-NSynonyms
956145-87-2(11~(S))~(N)((2~(S))4methyl1oxo1(3propan2yloxypropylamino)pentan2yl)9oxo1020diazapentacyclo(11700^(210)0^(38)0^(1419))icosa1(13)357141618heptaene11carboxamide
(7S)N((2S)4methyl1oxo1((3(propan2yloxy)propyl)amino)pentan2yl)5oxo781313btetrahydro5Hbenzo(12)indolizino(87b)indole7carboxamide
(7S)N((S)1((3isopropoxypropyl)amino)4methyl1oxopentan2yl)5oxo781313btetrahydro5Hbenzo(12)indolizino(87b)indole7carboxamide
16405234
956145872
CC(OCCCNC(=O)(C@@H)(NC(=O)(C@@H)1Cc2c(C3N1C(=O)c1c3cccc1)(nH)c1c2cccc1)CC(C)C)C
InChI=1SC31H38N4O4c118(2)1625(29(36)32149153919(3)4)3430(37)2617232010781324(20)3327(23)282111561222(21)31(38)35(26)28h581013181925262833H91417H214H3(H3236)(H3437)t252628?m0s1
MFCD06769591
ZINC000015970051
ZINC000070701523
Check stock
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Check stock on Vitas-MAvailable files
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