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

Catalog ID
STL550972
SMILES COc1c2c(CC[C@@H](c3c2ccc(c(=O)c3)NCCCCCC(=O)Nc2scc(n2)CC(=O)N)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 C32H39N5O7S MW 637.76 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H39N5O7S/c1-18(38)35-23-11-9-19-14-26(42-2)30(43-3)31(44-4)29(19)21-10-12-24(25(39)16-22(21)23)34-13-7-5-6-8-28(41)37-32-36-20(17-45-32)15-27(33)40/h10,12,14,16-17,23H,5-9,11,13,15H2,1-4H3,(H2,33,40)(H,34,39)(H,35,38)(H,36,37,41)/t23-/m0/s1
InChIKey
SPYUHNAPPUUQAV-QHCPKHFHSA-N
Synonyms

(S)6((7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(4(2amino2oxoethyl)thiazol2yl)hexanamide
125429934
6(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(4(2amino2oxoethyl)13thiazol2yl)hexanamide
6(((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(4(2amino2oxoethyl)13thiazol2yl)hexanamide
COc1c2c(CC(C@@H)(c3c2ccc(c(=O)c3)NCCCCCC(=O)Nc2scc(n2)CC(=O)N)NC(=O)C)cc(c1OC)OC
InChI=1SC32H39N5O7Sc118(38)3523119191426(422)30(433)31(444)29(19)21101224(25(39)1622(21)23)3413756828(41)37323620(174532)1527(33)40h101214161723H59111315H214H3(H23340)(H3439)(H3538)(H363741)t23m0s1
ZINC000524731321
ZINC524731321

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Available files

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