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Nalpha-{[(2R,6'R)-7-chloro-4,6-dimethoxy-2'-(4-methoxyphenyl)-6'-methyl-3,4'-dioxo-6',7'-dihydro-3H,4'H-2,5'-spirobi[[1]benzofuran]-3'-yl]acetyl}-N-methyl-D-tryptophanamide

Catalog ID
STL561561
SMILES CNC(=O)[C@@H](Cc1c[nH]c2c1cccc2)NC(=O)Cc1c(oc2c1C(=O)[C@]1([C@@H](C2)C)Oc2c(C1=O)c(OC)cc(c2Cl)OC)c1ccc(cc1)OC

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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 C39H36ClN3O9 MW 726.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C39H36ClN3O9/c1-19-14-28-31(36(45)39(19)37(46)32-27(49-4)17-29(50-5)33(40)35(32)52-39)24(34(51-28)20-10-12-22(48-3)13-11-20)16-30(44)43-26(38(47)41-2)15-21-18-42-25-9-7-6-8-23(21)25/h6-13,17-19,26,42H,14-16H2,1-5H3,(H,41,47)(H,43,44)/t19-,26-,39+
InChIKey
GGQWGWYFFRYWNG-OUYPFMINSA-N
Synonyms

(2R)2((2((2S6R)7chloro46dimethoxy2(4methoxyphenyl)6methyl34dioxospiro(1benzofuran2567dihydro1benzofuran)3yl)acetyl)amino)3(1Hindol3yl)Nmethylpropanamide
(R)2(2((2S6R)7chloro46dimethoxy2(4methoxyphenyl)6methyl34dioxo67dihydro3H4H25spirobi(benzofuran)3yl)acetamido)3(1Hindol3yl)Nmethylpropanamide
145704918
CNC(=O)(C@@H)(Cc1c(nH)c2c1cccc2)NC(=O)Cc1c(oc2c1C(=O)(C@)1((C@@H)(C2)C)Oc2c(C1=O)c(OC)cc(c2Cl)OC)c1ccc(cc1)OC
InChI=1SC39H36ClN3O9c119142831(36(45)39(19)37(46)3227(494)1729(505)33(40)35(32)5239)24(34(5128)20101222(483)131120)1630(44)4326(38(47)412)1521184225976823(21)25h61317192642H1416H215H3(H4147)(H4344)t192639+m1s1
MFCD32650626
Nalpha(((2R6R)7chloro46dimethoxy2(4methoxyphenyl)6methyl34dioxo67dihydro3H4H25spirobi((1)benzofuran)3yl)acetyl)NmethylDtryptophanamide
ZINC001848442698

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Available files

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