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N-[(7S)-1,2,3-trimethoxy-10-{[(2S)-1-(8-methoxy-1,3,4,5-tetrahydro-2H-pyrido[4,3-b]indol-2-yl)-1-oxopropan-2-yl]amino}-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-7-yl]acetamide

Catalog ID
STL549182
SMILES COc1ccc2c(c1)c1CN(CCc1[nH]2)C(=O)[C@@H](Nc1ccc2c(cc1=O)[C@H](CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)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 C36H40N4O7 MW 640.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H40N4O7/c1-19(36(43)40-14-13-29-26(18-40)24-16-22(44-3)8-11-28(24)39-29)37-30-12-9-23-25(17-31(30)42)27(38-20(2)41)10-7-21-15-32(45-4)34(46-5)35(47-6)33(21)23/h8-9,11-12,15-17,19,27,39H,7,10,13-14,18H2,1-6H3,(H,37,42)(H,38,41)/t19-,27-/m0/s1
InChIKey
NYXDPTHYBLUPOT-PPHZAIPVSA-N
Synonyms

~(N)((7~(S))123trimethoxy10(((2~(S))1(8methoxy1345tetrahydropyrido(43b)indol2yl)1oxopropan2yl)amino)9oxo67dihydro5~(H)benzo(a)heptalen7yl)acetamide
121541604
COc1ccc2c(c1)c1CN(CCc1(nH)2)C(=O)(C@@H)(Nc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)NC(=O)C)C
InChI=1SC36H40N4O7c119(36(43)4014132926(1840)241622(443)81128(24)3929)37301292325(1731(30)42)27(3820(2)41)107211532(454)34(465)35(476)33(21)23h8911121517192739H710131418H216H3(H3742)(H3841)t1927m0s1
N((7S)123trimethoxy10(((2S)1(8methoxy1345tetrahydro2Hpyrido(43b)indol2yl)1oxopropan2yl)amino)9oxo5679tetrahydrobenzo(a)heptalen7yl)acetamide
N((S)123trimethoxy10(((S)1(8methoxy34dihydro1Hpyrido(43b)indol2(5H)yl)1oxopropan2yl)amino)9oxo5679tetrahydrobenzo(a)heptalen7yl)acetamide
ZINC000263585934
ZINC263585934

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Available files

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