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N~2~-[(7S)-7-(acetylamino)-1,2,3-trimethoxy-9-oxo-5,6,7,9-tetrahydrobenzo[a]heptalen-10-yl]-N-[2-(2-methoxyphenoxy)ethyl]-L-alaninamide

Catalog ID
STL542673
SMILES COc1c(OC)cc2c(c1OC)c1ccc(c(=O)cc1[C@H](CC2)NC(=O)C)N[C@H](C(=O)NCCOc1ccccc1OC)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 C33H39N3O8 MW 605.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H39N3O8/c1-19(33(39)34-15-16-44-28-10-8-7-9-27(28)40-3)35-25-14-12-22-23(18-26(25)38)24(36-20(2)37)13-11-21-17-29(41-4)31(42-5)32(43-6)30(21)22/h7-10,12,14,17-19,24H,11,13,15-16H2,1-6H3,(H,34,39)(H,35,38)(H,36,37)/t19-,24-/m0/s1
InChIKey
JSYBSCYBFUCPFU-CYFREDJKSA-N
Synonyms
1574360-40-9
(2~(S))2(((7~(S))7acetamido123trimethoxy9oxo67dihydro5~(H)benzo(a)heptalen10yl)amino)~(N)(2(2methoxyphenoxy)ethyl)propanamide
(S)2(((S)7acetamido123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)amino)N(2(2methoxyphenoxy)ethyl)propanamide
1574360409
75491734
COc1c(OC)cc2c(c1OC)c1ccc(c(=O)cc1(C@H)(CC2)NC(=O)C)N(C@H)(C(=O)NCCOc1ccccc1OC)C
InChI=1SC33H39N3O8c119(33(39)34151644281087927(28)403)352514122223(1826(25)38)24(3620(2)37)1311211729(414)31(425)32(436)30(21)22h7101214171924H11131516H216H3(H3439)(H3538)(H3637)t1924m0s1
N~2~((7S)7(acetylamino)123trimethoxy9oxo5679tetrahydrobenzo(a)heptalen10yl)N(2(2methoxyphenoxy)ethyl)Lalaninamide
ZINC000108449380
ZINC108449380

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Available files

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