Vitas-M small molecule compound

3-methyl-6-oxo-7,8,9,10-tetrahydro-6H-benzo[c]chromen-1-yl N-[(benzyloxy)carbonyl]-L-leucinate

Catalog ID
STL462536
SMILES CC(C[C@@H](C(=O)Oc1cc(C)cc2c1c1CCCCc1c(=O)o2)NC(=O)OCc1ccccc1)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 C28H31NO6 MW 477.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31NO6/c1-17(2)13-22(29-28(32)33-16-19-9-5-4-6-10-19)27(31)35-24-15-18(3)14-23-25(24)20-11-7-8-12-21(20)26(30)34-23/h4-6,9-10,14-15,17,22H,7-8,11-13,16H2,1-3H3,(H,29,32)/t22-/m0/s1
InChIKey
LSITZVLLHUFTEJ-QFIPXVFZSA-N
Synonyms
956046-43-8
(3methyl6oxo78910tetrahydrobenzo(c)chromen1yl)(2S)4methyl2(phenylmethoxycarbonylamino)pentanoate
(S)3methyl6oxo78910tetrahydro6Hbenzo(c)chromen1yl2(((benzyloxy)carbonyl)amino)4methylpentanoate
3methyl6oxo78910tetrahydro6Hbenzo(c)chromen1ylN((benzyloxy)carbonyl)Lleucinate
956046438
CC(C(C@@H)(C(=O)Oc1cc(C)cc2c1c1CCCCc1c(=O)o2)NC(=O)OCc1ccccc1)C
CC1=CC2=C(C3=C(CCCC3)C(=O)O2)C(=C1)OC(=O)C(CC(C)C)NC(=O)OCC4=CC=CC=C4
InChI=1SC28H31NO6c117(2)1322(2928(32)33161995461019)27(31)35241518(3)142325(24)2011781221(20)26(30)3423h4691014151722H78111316H213H3(H2932)t22m0s1
ZINC000002154007
ZINC02154007
ZINC2154007

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Available files

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