Vitas-M small molecule compound

pentacyclo[6.6.6.0~2,7~.0~9,14~.0~15,20~]icosa-2,4,6,9,11,13,15,17,19-nonaene-1-carbaldehyde (non-preferred name)

Catalog ID
STK369457
SMILES O=CC12c3ccccc3C(c3c1cccc3)c1c2cccc1

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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 C21H14O MW 282.34 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H14O/c22-13-21-17-10-4-1-7-14(17)20(15-8-2-5-11-18(15)21)16-9-3-6-12-19(16)21/h1-13,20H
InChIKey
YCUJEHWKRVARJN-UHFFFAOYSA-N
Synonyms
1469-54-1
1469541
910DIHYDRO910(12)BENZENOANTHRACENE9CARBALDEHYDE
C1=CC=C2C(=C1)C3C4=CC=CC=C4C2(C5=CC=CC=C35)C=O
InChI=1SC21H14Oc221321171041714(17)20(158251118(15)21)169361219(16)21h11320H
MFCD02066872
pentacyclo(6660~27~0~914~0~1520~)icosa24691113151719nonaene1carbaldehyde(nonpreferredname)
ZINC000004017563
ZINC04017563
ZINC4017563

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Available files

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