Vitas-M small molecule compound
(1'R,2'R)-1'-acetyl-2'-(3-methoxyphenyl)-1,3-dioxo-1,1',2',3-tetrahydro-3a'H-spiro[indene-2,3'-pyrrolo[1,2-a]quinolin]-9'-yl acetate
Catalog ID
STL538185
SMILES COc1cccc(c1)[C@H]1[C@H](C(=O)C)N2C([C@@]31C(=O)c1c(C3=O)cccc1)C=Cc1c2c(ccc1)OC(=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 C31H25NO6 MW 507.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H25NO6/c1-17(33)27-26(20-9-6-10-21(16-20)37-3)31(29(35)22-11-4-5-12-23(22)30(31)36)25-15-14-19-8-7-13-24(38-18(2)34)28(19)32(25)27/h4-16,25-27H,1-3H3/t25?,26-,27-/m0/s1InChIKey
LZWPPLXYTQMXFG-DCYPJBMNSA-NSynonyms
1216946-49-4((1~(R)2~(R))1acetyl2(3methoxyphenyl)13dioxospiro(23~(a)dihydro1~(H)pyrrolo(12a)quinoline32indene)9yl)acetate
(1R2R)1acetyl2(3methoxyphenyl)13dioxo1123tetrahydro3aHspiro(indene23pyrrolo(12a)quinolin)9ylacetate
(1R2R)1acetyl2(3methoxyphenyl)13dioxo1233atetrahydro1Hspiro(indene23pyrrolo(12a)quinolin)9ylacetate
1216946494
16400067
COc1cccc(c1)(C@H)1(C@H)(C(=O)C)N2C(C31C(=O)c1c(C3=O)cccc1)C=Cc1c2c(ccc1)OC(=O)C
InChI=1SC31H25NO6c117(33)2726(20961021(1620)373)31(29(35)2211451223(22)30(31)36)25151419871324(3818(2)34)28(19)32(25)27h4162527H13H3t25?2627m0s1
MFCD05670794
ZINC000008918043
ZINC000008918583
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