Vitas-M small molecule compound

methyl 6-({[(1R,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]carbonyl}amino)hexanoate

Catalog ID
STL563111
SMILES COC(=O)CCCCCNC(=O)N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1

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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 C19H27N3O4 MW 361.44 g/mol Purity >90% as per NMR
InChI
InChI=1S/C19H27N3O4/c1-26-18(24)8-3-2-4-9-20-19(25)21-11-14-10-15(13-21)16-6-5-7-17(23)22(16)12-14/h5-7,14-15H,2-4,8-13H2,1H3,(H,20,25)/t14-,15+/m0/s1
InChIKey
VWMBGCSZQWYTOT-LSDHHAIUSA-N
Synonyms

1763451
COC(=O)CCCCCNC(=O)N1C(C@@H)2C(C@H)(C1)c1n(C2)c(=O)ccc1
InChI=1SC19H27N3O4c12618(24)832492019(25)2111141015(1321)1665717(23)22(16)1214h571415H24813H21H3(H2025)t1415+m0s1
methyl6((((1R5R)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)carbonyl)amino)hexanoate
methyl6(((1R9R)6oxo711diazatricyclo(731027)trideca24diene11carbonyl)amino)hexanoate
methyl6((1R5R)8oxo234568hexahydro1H15methanopyrido(12a)(15)diazocine3carboxamido)hexanoate
MFCD32651397
ZINC000002108303

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Available files

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