Vitas-M small molecule compound

4-({N~5~-carbamoyl-N~2~-[3-(2,3,5-trimethyl-7-oxo-7H-furo[3,2-g]chromen-6-yl)propanoyl]-L-ornithyl}amino)butanoic acid

Catalog ID
STL530671
SMILES O=C(N[C@H](C(=O)NCCCC(=O)O)CCCNC(=O)N)CCc1c(=O)oc2c(c1C)cc1c(c2)oc(c1C)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 C27H34N4O8 MW 542.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C27H34N4O8/c1-14-16(3)38-21-13-22-19(12-18(14)21)15(2)17(26(36)39-22)8-9-23(32)31-20(6-4-11-30-27(28)37)25(35)29-10-5-7-24(33)34/h12-13,20H,4-11H2,1-3H3,(H,29,35)(H,31,32)(H,33,34)(H3,28,30,37)/t20-/m0/s1
InChIKey
JTDOAMTVIMBOOQ-FQEVSTJZSA-N
Synonyms
956980-67-9
(S)4(2(3(235trimethyl7oxo7Hfuro(32g)chromen6yl)propanamido)5ureidopentanamido)butanoicacid
16405733
4(((2~(S))5(carbamoylamino)2(3(235trimethyl7oxofuro(32g)chromen6yl)propanoylamino)pentanoyl)amino)butanoicacid
4((N~5~carbamoylN~2~(3(235trimethyl7oxo7Hfuro(32g)chromen6yl)propanoyl)Lornithyl)amino)butanoicacid
4((N5CARBAMOYLN2(3(235TRIMETHYL7OXO7HFURO(32G)CHROMEN6YL)PROPANOYL)LORNITHYL)AMINO)BUTANOICACID
956980679
InChI=1SC27H34N4O8c11416(3)3821132219(1218(14)21)15(2)17(26(36)3922)8923(32)3120(64113027(28)37)25(35)29105724(33)34h121320H411H213H3(H2935)(H3132)(H3334)(H3283037)t20m0s1
MFCD08002436
O=C(N(C@H)(C(=O)NCCCC(=O)O)CCCNC(=O)N)CCc1c(=O)oc2c(c1C)cc1c(c2)oc(c1C)C
ZINC000070705490
ZINC70705490

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Available files

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