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N-(4-{[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]amino}butanoyl)-L-tryptophan

Catalog ID
STL543651
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCCCC(=O)N[C@H](C(=O)O)Cc2c[nH]c3c2cccc3)NC(=O)C)cc(c1OC)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 C36H40N4O8 MW 656.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C36H40N4O8/c1-20(41)39-27-13-11-21-17-31(46-2)34(47-3)35(48-4)33(21)24-12-14-28(30(42)18-25(24)27)37-15-7-10-32(43)40-29(36(44)45)16-22-19-38-26-9-6-5-8-23(22)26/h5-6,8-9,12,14,17-19,27,29,38H,7,10-11,13,15-16H2,1-4H3,(H,37,42)(H,39,41)(H,40,43)(
InChIKey
PFFBRSVQDXEGKJ-YTMVLYRLSA-N
Synonyms

(2~(S))2(4(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)butanoylamino)3(1~(H)indol3yl)propanoicacid
(S)2(4(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)butanamido)3(1Hindol3yl)propanoicacid
110206314
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NCCCC(=O)N(C@H)(C(=O)O)Cc2c(nH)c3c2cccc3)NC(=O)C)cc(c1OC)OC
InChI=1SC36H40N4O8c120(41)39271311211731(462)34(473)35(484)33(21)24121428(30(42)1825(24)27)371571032(43)4029(36(44)45)1622193826965823(22)26h568912141719272938H71011131516H214H3(H3742)(H3941)(H4043)(H4445)t2729m0s1
N(4(((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)butanoyl)Ltryptophan
ZINC000253411869
ZINC253411869

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Available files

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