Vitas-M small molecule compound
(3S,3aR,4aR,8aR,9aR)-3-(((2,3-dimethoxybenzyl)(3-morpholinopropyl)amino)methyl)-8a-methyldecahydro-2H-spiro[naphtho[2,3-b]furan-5,2'-oxiran]-2-one
Catalog ID
STL541121
SMILES COc1cccc(c1OC)CN(CC1C(=O)O[C@H]2[C@@H]1C[C@@H]1[C@](C2)(C)CCCC21OC2)CCCN1CCOCC1
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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 C31H46N2O6 MW 542.72 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H46N2O6/c1-30-9-5-10-31(21-38-31)27(30)17-23-24(29(34)39-26(23)18-30)20-33(12-6-11-32-13-15-37-16-14-32)19-22-7-4-8-25(35-2)28(22)36-3/h4,7-8,23-24,26-27H,5-6,9-21H2,1-3H3/t23-,24?,26-,27-,30-,31?/m1/s1InChIKey
ZVTQKMMWAIIGFJ-PGYQPQJDSA-NSynonyms
956913-66-9(3~(a)~(R)4~(a)~(R)8~(a)~(R)9~(a)~(R))3(((23dimethoxyphenyl)methyl(3morpholin4ylpropyl)amino)methyl)8~(a)methylspiro(3~(a)44~(a)67899~(a)octahydro3~(H)benzo(f)(1)benzofuran52oxirane)2one
(3S3aR4aR8aR9aR)3(((23dimethoxybenzyl)(3morpholinopropyl)amino)methyl)8amethyldecahydro2Hspiro(naphtho(23b)furan52oxiran)2one
16400479
956913669
COc1cccc(c1OC)CN(CC1C(=O)O(C@H)2(C@@H)1C(C@@H)1(C@)(C2)(C)CCCC21OC2)CCCN1CCOCC1
InChI=1SC31H46N2O6c130951031(213831)27(30)172324(29(34)3926(23)1830)2033(1261132131537161432)192274825(352)28(22)363h47823242627H56921H213H3t2324?26273031?m1s1
ZINC000070687477
ZINC000070687485
Check stock
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Check stock on Vitas-MAvailable files
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