Vitas-M small molecule compound
4-(2,2-dimethyl-4-oxo-1,2,3,4,5,6-hexahydrobenzo[a]phenanthridin-5-yl)-2,6-dimethoxyphenyl acetate
Catalog ID
STK759837
SMILES COc1cc(cc(c1OC(=O)C)OC)C1Nc2ccc3c(c2C2=C1C(=O)CC(C2)(C)C)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 C29H29NO5 MW 471.55 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H29NO5/c1-16(31)35-28-23(33-4)12-18(13-24(28)34-5)27-26-20(14-29(2,3)15-22(26)32)25-19-9-7-6-8-17(19)10-11-21(25)30-27/h6-13,27,30H,14-15H2,1-5H3InChIKey
WNRLXBGFCIJNEF-UHFFFAOYSA-NSynonyms
5795-82-4(4(22dimethyl4oxo1356tetrahydrobenzo(a)phenanthridin5yl)26dimethoxyphenyl)acetate
4(22dimethyl4oxo123456hexahydrobenzo(a)phenanthridin5yl)26dimethoxyphenylacetate
5795824
CC(=O)OC1=C(C=C(C=C1OC)C2C3=C(CC(CC3=O)(C)C)C4=C(N2)C=CC5=CC=CC=C54)OC
InChI=1SC29H29NO5c116(31)352823(334)1218(1324(28)345)272620(1429(23)1522(26)32)2519976817(19)101121(25)3027h6132730H1415H215H3
MFCD01572861
ZINC000001062665
ZINC000001062667
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