Vitas-M small molecule compound
(E)-{1-[3-(morpholin-4-ium-4-yl)propyl]-4,5-dioxo-2-[4-(propan-2-yloxy)phenyl]pyrrolidin-3-ylidene}[4-(propan-2-yloxy)phenyl]methanolate
Catalog ID
STL047594
SMILES CC(Oc1ccc(cc1)C1N(CCC[NH+]2CCOCC2)C(=O)C(=O)/C/1=C(\c1ccc(cc1)OC(C)C)/[O-])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 C30H38N2O6 MW 522.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H38N2O6/c1-20(2)37-24-10-6-22(7-11-24)27-26(28(33)23-8-12-25(13-9-23)38-21(3)4)29(34)30(35)32(27)15-5-14-31-16-18-36-19-17-31/h6-13,20-21,27,33H,5,14-19H2,1-4H3/b28-26+InChIKey
PBBLVIOPFIEUNE-BYCLXTJYSA-NSynonyms
848741-21-9(4E)4(HYDROXY(4PROPAN2YLOXYPHENYL)METHYLIDENE)1(3MORPHOLIN4YLPROPYL)5(4PROPAN2YLOXYPHENYL)PYRROLIDINE23DIONE
(E)(1(3(morpholin4ium4yl)propyl)45dioxo2(4(propan2yloxy)phenyl)pyrrolidin3ylidene)(4(propan2yloxy)phenyl)methanolate
(E)(1(3MORPHOLIN4IUM4YLPROPYL)45DIOXO2(4PROPAN2YLOXYPHENYL)PYRROLIDIN3YLIDENE)(4PROPAN2YLOXYPHENYL)METHANOLATE
3HYDROXY5(4(METHYLETHOXY)PHENYL)4((4(METHYLETHOXY)PHENYL)CARBONYL)1(3MORPHOLIN4YLPROPYL)3PYRROLIN2ONE
848741219
CC(C)OC1=CC=C(C=C1)C2C(=C(C3=CC=C(C=C3)OC(C)C)(O))C(=O)C(=O)N2CCC(NH+)4CCOCC4
CC(Oc1ccc(cc1)C1N(CCC(NH+)2CCOCC2)C(=O)C(=O)C1=C(c1ccc(cc1)OC(C)C)(O))C
InChI=1SC30H38N2O6c120(2)372410622(71124)2726(28(33)2381225(13923)3821(3)4)29(34)30(35)32(27)1551431161836191731h61320212733H51419H214H3b2826+
MFCD18249099
ZINC000009043451
ZINC000009175886
Check stock
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