Vitas-M small molecule compound

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

Catalog ID
STL531517
SMILES O=C([C@@H](NC(=O)[C@@H]1Cc2c(C3N1C(=O)c1c3cccc1)[nH]c1c2cccc1)C)NCCC1=CCCCC1

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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 C30H32N4O3 MW 496.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H32N4O3/c1-18(28(35)31-16-15-19-9-3-2-4-10-19)32-29(36)25-17-23-20-11-7-8-14-24(20)33-26(23)27-21-12-5-6-13-22(21)30(37)34(25)27/h5-9,11-14,18,25,27,33H,2-4,10,15-17H2,1H3,(H,31,35)(H,32,36)/t18-,25-,27?/m0/s1
InChIKey
DROJOGMMZLHURQ-YZAZIPGMSA-N
Synonyms
956958-34-2
(11~(S))~(N)((2~(S))1(2(cyclohexen1yl)ethylamino)1oxopropan2yl)9oxo1020diazapentacyclo(11700^(210)0^(38)0^(1419))icosa1(13)357141618heptaene11carboxamide
(7S)N((2S)1((2(cyclohex1en1yl)ethyl)amino)1oxopropan2yl)5oxo781313btetrahydro5Hbenzo(12)indolizino(87b)indole7carboxamide
(7S)N((S)1((2(cyclohex1en1yl)ethyl)amino)1oxopropan2yl)5oxo781313btetrahydro5Hbenzo(12)indolizino(87b)indole7carboxamide
16405354
956958342
InChI=1SC30H32N4O3c118(28(35)3116151993241019)3229(36)2517232011781424(20)3326(23)272112561322(21)30(37)34(25)27h59111418252733H24101517H21H3(H3135)(H3236)t182527?m0s1
MFCD06770201
O=C((C@@H)(NC(=O)(C@@H)1Cc2c(C3N1C(=O)c1c3cccc1)(nH)c1c2cccc1)C)NCCC1=CCCCC1
ZINC000008791610
ZINC000012887652

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Available files

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