Vitas-M small molecule compound
(2'S,3S,3'S,10b'R)-3'-{[4-(propan-2-yloxy)phenyl]carbonyl}-2'-[(4-propylphenyl)carbonyl]-2',3'-dihydro-10b'H-spiro[indole-3,1'-pyrrolo[2,1-a]isoquinolin]-2(1H)-one
Catalog ID
STK586513
SMILES CCCc1ccc(cc1)C(=O)[C@@H]1[C@@H](C(=O)c2ccc(cc2)OC(C)C)N2[C@@H]([C@@]31C(=O)Nc1c3cccc1)c1ccccc1C=C2
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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 C39H36N2O4 MW 596.73 g/mol Purity >90% as per NMR
InChI
InChI=1S/C39H36N2O4/c1-4-9-25-14-16-27(17-15-25)35(42)33-34(36(43)28-18-20-29(21-19-28)45-24(2)3)41-23-22-26-10-5-6-11-30(26)37(41)39(33)31-12-7-8-13-32(31)40-38(39)44/h5-8,10-24,33-34,37H,4,9H2,1-3H3,(H,40,44)/t33-,34-,37+,39+/m0/s1InChIKey
FNVJLFVYHKUHEC-LTBWJRBPSA-NSynonyms
1212310-46-7(1S2S3S10bR)3(4isopropoxybenzoyl)2(4propylbenzoyl)310bdihydro2Hspiro(indoline31pyrrolo(21a)isoquinolin)2one
(2S3S3S10bR)3((4(propan2yloxy)phenyl)carbonyl)2((4propylphenyl)carbonyl)23dihydro10bHspiro(indole31pyrrolo(21a)isoquinolin)2(1H)one
(2S3S3S10bR)3(4propan2yloxybenzoyl)2(4propylbenzoyl)spiro(1Hindole31310bdihydro2Hpyrrolo(21a)isoquinoline)2one
1212310467
CCCC1=CC=C(C=C1)C(=O)C2C(N3C=CC4=CC=CC=C4C3C25C6=CC=CC=C6NC5=O)C(=O)C7=CC=C(C=C7)OC(C)C
CCCc1ccc(cc1)C(=O)(C@@H)1(C@@H)(C(=O)c2ccc(cc2)OC(C)C)N2(C@@H)((C@@)31C(=O)Nc1c3cccc1)c1ccccc1C=C2
InChI=1SC39H36N2O4c14925141627(171525)35(42)3334(36(43)28182029(211928)4524(2)3)4123222610561130(26)37(41)39(33)3112781332(31)4038(39)44h581024333437H49H213H3(H4044)t333437+39+m0s1
MFCD18158301
ZINC000101670279
ZINC101670279
Check stock
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