Vitas-M small molecule compound

7-[(2-hydroxybenzyl)(methyl)amino]-1,2,3,10-tetramethoxy-6,7-dihydrobenzo[a]heptalen-9(5H)-one

Catalog ID
STL372812
SMILES COc1ccc2c(cc1=O)C(CCc1c2c(OC)c(c(c1)OC)OC)N(Cc1ccccc1O)C

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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 C28H31NO6 MW 477.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C28H31NO6/c1-29(16-18-8-6-7-9-22(18)30)21-12-10-17-14-25(33-3)27(34-4)28(35-5)26(17)19-11-13-24(32-2)23(31)15-20(19)21/h6-9,11,13-15,21,30H,10,12,16H2,1-5H3
InChIKey
SOFSXTKPGSIDCI-UHFFFAOYSA-N
Synonyms
16892-03-8
(S)7((2hydroxybenzyl)(methyl)amino)12310tetramethoxy67dihydrobenzo(a)heptalen9(5H)one
16892038
7((2hydroxybenzyl)(methyl)amino)12310tetramethoxy67dihydrobenzo(a)heptalen9(5H)one
7((2hydroxyphenyl)methylmethylamino)12310tetramethoxy67dihydro5Hbenzo(a)heptalen9one
CN(CC1=CC=CC=C1O)C2CCC3=CC(=C(C(=C3C4=CC=C(C(=O)C=C24)OC)OC)OC)OC
COc1ccc2c(cc1=O)(C@H)(CCc1c2c(OC)c(c(c1)OC)OC)N(Cc1ccccc1O)C
InChI=1SC28H31NO6c129(1618867922(18)30)211210171425(333)27(344)28(355)26(17)19111324(322)23(31)1520(19)21h691113152130H101216H215H3
MFCD01002954
SPECIOSIN
SPECIOSINE(6CI8CI)
SPECIOZIN
SPECIOZINE
ZINC000000689682
ZINC000002018257

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Available files

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