Vitas-M small molecule compound

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

Catalog ID
STL462377
SMILES O=C(N[C@H](C(=O)Oc1ccc2c(c1C)oc(=O)c1c2CCCC1)C(C)C)OCc1ccccc1

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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 C27H29NO6 MW 463.53 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H29NO6/c1-16(2)23(28-27(31)32-15-18-9-5-4-6-10-18)26(30)33-22-14-13-20-19-11-7-8-12-21(19)25(29)34-24(20)17(22)3/h4-6,9-10,13-14,16,23H,7-8,11-12,15H2,1-3H3,(H,28,31)/t23-/m0/s1
InChIKey
YAGVTFSNGIBHHF-QHCPKHFHSA-N
Synonyms
956049-23-3
(4methyl6oxo78910tetrahydrobenzo(c)chromen3yl)(2S)3methyl2(phenylmethoxycarbonylamino)butanoate
(S)4methyl6oxo78910tetrahydro6Hbenzo(c)chromen3yl2(((benzyloxy)carbonyl)amino)3methylbutanoate
4methyl6oxo78910tetrahydro6Hbenzo(c)chromen3ylN((benzyloxy)carbonyl)Lvalinate
956049233
CC1=C(C=CC2=C1OC(=O)C3=C2CCCC3)OC(=O)C(C(C)C)NC(=O)OCC4=CC=CC=C4
InChI=1SC27H29NO6c116(2)23(2827(31)32151895461018)26(30)33221413201911781221(19)25(29)3424(20)17(22)3h4691013141623H78111215H213H3(H2831)t23m0s1
O=C(N(C@H)(C(=O)Oc1ccc2c(c1C)oc(=O)c1c2CCCC1)C(C)C)OCc1ccccc1
ZINC000002093962
ZINC02093962
ZINC2093962

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Available files

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