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-3,6-diol (non-preferred name)

Catalog ID
STK367285
SMILES Oc1ccc(c2c1C1c3ccccc3C2c2c1cccc2)O

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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 C20H14O2 MW 286.33 g/mol Purity >90% as per NMR
InChI
InChI=1S/C20H14O2/c21-15-9-10-16(22)20-18-12-6-2-1-5-11(12)17(19(15)20)13-7-3-4-8-14(13)18/h1-10,17-18,21-22H
InChIKey
LXCHSZSNUOVMSM-UHFFFAOYSA-N
Synonyms
5969-70-0
5969700
910DIHYDRO910(12)BENZENOANTHRACENE14DIOL
910DIHYDRO9BETA10BETA(12)BENZENOANTHRACENE14DIOL
C1=CC=C2C3C4=CC=CC=C4C(C2=C1)C5=C(C=CC(=C35)O)O
InChI=1SC20H14O2c211591016(22)201812621511(12)17(19(15)20)13734814(13)18h11017182122H
MFCD00408310
pentacyclo(6660~27~0~914~0~1520~)icosa24691113151719nonaene36diol(nonpreferredname)
ZINC000003995433
ZINC03995433
ZINC3995433

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Available files

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