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3-(3-hydroxy-4-oxo-6-{[(1S,5R)-8-oxo-1,5,6,8-tetrahydro-2H-1,5-methanopyrido[1,2-a][1,5]diazocin-3(4H)-yl]methyl}-4H-pyran-2-yl)-3-[3-(pyrimidin-2-yloxy)phenyl]propanamide

Catalog ID
STL551195
SMILES NC(=O)CC(c1oc(CN2C[C@H]3C[C@@H](C2)c2n(C3)c(=O)ccc2)cc(=O)c1O)c1cccc(c1)Oc1ncccn1

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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 C30H29N5O6 MW 555.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N5O6/c31-26(37)13-23(19-4-1-5-21(11-19)41-30-32-8-3-9-33-30)29-28(39)25(36)12-22(40-29)17-34-14-18-10-20(16-34)24-6-2-7-27(38)35(24)15-18/h1-9,11-12,18,20,23,39H,10,13-17H2,(H2,31,37)/t18-,20+,23?/m1/s1
InChIKey
LRHIJUHNIMNCGA-KPNPHKMBSA-N
Synonyms

129894833
3(3hydroxy4oxo6(((1~(S)9~(R))6oxo711diazatricyclo(7310^(27))trideca24dien11yl)methyl)pyran2yl)3(3pyrimidin2yloxyphenyl)propanamide
3(3hydroxy4oxo6(((1R5S)8oxo56dihydro1H15methanopyrido(12a)(15)diazocin3(2H4H8H)yl)methyl)4Hpyran2yl)3(3(pyrimidin2yloxy)phenyl)propanamide
3(3hydroxy4oxo6(((1S5R)8oxo1568tetrahydro2H15methanopyrido(12a)(15)diazocin3(4H)yl)methyl)4Hpyran2yl)3(3(pyrimidin2yloxy)phenyl)propanamide
InChI=1SC30H29N5O6c3126(37)1323(1941521(1119)4130328393330)2928(39)25(36)1222(4029)173414181020(1634)2462727(38)35(24)1518h19111218202339H101317H2(H23137)t1820+23?m1s1
NC(=O)CC(c1oc(CN2C(C@H)3C(C@@H)(C2)c2n(C3)c(=O)ccc2)cc(=O)c1O)c1cccc(c1)Oc1ncccn1
ZINC000524729266
ZINC000524729267

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Available files

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