Vitas-M small molecule compound

(1S,5R)-3-[3-(2,5,9-trimethyl-7-oxo-3-phenyl-7H-furo[3,2-g]chromen-6-yl)propanoyl]-1,2,3,4,5,6-hexahydro-8H-1,5-methanopyrido[1,2-a][1,5]diazocin-8-one

Catalog ID
STL534102
SMILES O=C(N1C[C@H]2C[C@@H](C1)c1n(C2)c(=O)ccc1)CCc1c(=O)oc2c(c1C)cc1c(c2C)oc(c1c1ccccc1)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 C34H32N2O5 MW 548.64 g/mol Purity >90% as per NMR
InChI
InChI=1S/C34H32N2O5/c1-19-25(12-13-29(37)35-16-22-14-24(18-35)28-10-7-11-30(38)36(28)17-22)34(39)41-32-20(2)33-27(15-26(19)32)31(21(3)40-33)23-8-5-4-6-9-23/h4-11,15,22,24H,12-14,16-18H2,1-3H3/t22-,24+/m0/s1
InChIKey
CRAQGCAKMOITIW-LADGPHEKSA-N
Synonyms

(1R5S)3(3(259trimethyl7oxo3phenyl7Hfuro(32g)chromen6yl)propanoyl)3456tetrahydro1H15methanopyrido(12a)(15)diazocin8(2H)one
(1S5R)3(3(259trimethyl7oxo3phenyl7Hfuro(32g)chromen6yl)propanoyl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
InChI=1SC34H32N2O5c11925(121329(37)3516221424(1835)281071130(38)36(28)1722)34(39)413220(2)3327(1526(19)32)31(21(3)4033)238546923h411152224H12141618H213H3t2224+m0s1
MFCD08283440
O=C(N1C(C@H)2C(C@@H)(C1)c1n(C2)c(=O)ccc1)CCc1c(=O)oc2c(c1C)cc1c(c2C)oc(c1c1ccccc1)C
ZINC000070707858

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Available files

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