Vitas-M small molecule compound

tridecyl (16,18-dioxo-17-azapentacyclo[6.6.5.0~2,7~.0~9,14~.0~15,19~]nonadeca-2,4,6,9,11,13-hexaen-17-yl)acetate (non-preferred name)

Catalog ID
STK268654
SMILES CCCCCCCCCCCCCOC(=O)CN1C(=O)C2C(C1=O)C1c3c(C2c2c1cccc2)cccc3

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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 C33H41NO4 MW 515.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H41NO4/c1-2-3-4-5-6-7-8-9-10-11-16-21-38-27(35)22-34-32(36)30-28-23-17-12-13-18-24(23)29(31(30)33(34)37)26-20-15-14-19-25(26)28/h12-15,17-20,28-31H,2-11,16,21-22H2,1H3
InChIKey
NOBRHLLQMLKYTD-UHFFFAOYSA-N
Synonyms

CCCCCCCCCCCCCOC(=O)CN1C(=O)C2C(C1=O)C3C4=CC=CC=C4C2C5=CC=CC=C35
InChI=1SC33H41NO4c123456789101116213827(35)223432(36)3028231712131824(23)29(31(30)33(34)37)262015141925(26)28h121517202831H211162122H21H3
MFCD01174837
tridecyl(1618dioxo17azapentacyclo(6650~27~0~914~0~1519~)nonadeca24691113hexaen17yl)acetate(nonpreferredname)
ZINC000097945236
ZINC000097945238

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.