Vitas-M small molecule compound

N~5~-carbamoyl-N~2~-[3-(4-methyl-2-oxo-6,7,8,9-tetrahydro-2H-[1]benzofuro[3,2-g]chromen-3-yl)propanoyl]-L-ornithine

Catalog ID
STL528857
SMILES O=C(N[C@H](C(=O)O)CCCNC(=O)N)CCc1c(=O)oc2c(c1C)cc1c(c2)oc2c1CCCC2

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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 C25H29N3O7 MW 483.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H29N3O7/c1-13-14(8-9-22(29)28-18(23(30)31)6-4-10-27-25(26)33)24(32)35-20-12-21-17(11-16(13)20)15-5-2-3-7-19(15)34-21/h11-12,18H,2-10H2,1H3,(H,28,29)(H,30,31)(H3,26,27,33)/t18-/m0/s1
InChIKey
GKQVEGVYFVFOQA-SFHVURJKSA-N
Synonyms
956382-85-7
(2~(S))5(carbamoylamino)2(3(4methyl2oxo6789tetrahydro(1)benzofuro(32g)chromen3yl)propanoylamino)pentanoicacid
(S)2(3(4methyl2oxo6789tetrahydro2Hbenzofuro(32g)chromen3yl)propanamido)5ureidopentanoicacid
1757570
956382857
InChI=1SC25H29N3O7c11314(8922(29)2818(23(30)31)64102725(26)33)24(32)3520122117(1116(13)20)15523719(15)3421h111218H210H21H3(H2829)(H3031)(H3262733)t18m0s1
N~5~carbamoylN~2~(3(4methyl2oxo6789tetrahydro2H(1)benzofuro(32g)chromen3yl)propanoyl)Lornithine
O=C(N(C@H)(C(=O)O)CCCNC(=O)N)CCc1c(=O)oc2c(c1C)cc1c(c2)oc2c1CCCC2
ZINC000082056196
ZINC82056196

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Available files

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