Vitas-M small molecule compound
1-methyl-1-(phenylcarbonyl)-1a-[(2E)-3-phenylprop-2-enoyl]-1a,9c-dihydrobenzo[f]cyclopropa[c]chromen-2(1H)-one
Catalog ID
STL345793
SMILES O=C(C1(C)C2C1(C(=O)/C=C/c1ccccc1)C(=O)Oc1c2c2ccccc2cc1)c1ccccc1
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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 C31H22O4 MW 458.51 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H22O4/c1-30(28(33)22-13-6-3-7-14-22)27-26-23-15-9-8-12-21(23)17-18-24(26)35-29(34)31(27,30)25(32)19-16-20-10-4-2-5-11-20/h2-19,27H,1H3/b19-16+InChIKey
DRACRFARLBOXGF-KNTRCKAVSA-NSynonyms
1192741-29-91192741299
1benzoyl1acinnamoyl1methyl19cdihydrobenzo(f)cyclopropa(c)chromen2(1aH)one
1methyl1(phenylcarbonyl)1a((2E)3phenylprop2enoyl)1a9cdihydrobenzo(f)cyclopropa(c)chromen2(1H)one
CC1(C2C1(C(=O)OC3=C2C4=CC=CC=C4C=C3)C(=O)C=CC5=CC=CC=C5)C(=O)C6=CC=CC=C6
InChI=1SC31H22O4c130(28(33)22136371422)27262315981221(23)171824(26)3529(34)31(2730)25(32)191620104251120h21927H1H3b1916+
MFCD04191955
O=C(C1(C)C2C1(C(=O)C=Cc1ccccc1)C(=O)Oc1c2c2ccccc2cc1)c1ccccc1
ZINC000009209492
ZINC000105336853
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