Vitas-M small molecule compound

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

Catalog ID
STL511703
SMILES O=C(N1CC2CC(C1)c1n(C2)c(=O)c(cc1)[N+](=O)[O-])Cc1c(=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 C33H29N3O7 MW 579.61 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H29N3O7/c1-17-23-12-25-29(21-7-5-4-6-8-21)19(3)42-31(25)18(2)30(23)43-33(39)24(17)13-28(37)34-14-20-11-22(16-34)26-9-10-27(36(40)41)32(38)35(26)15-20/h4-10,12,20,22H,11,13-16H2,1-3H3
InChIKey
JSLVYTRTXPUTBZ-UHFFFAOYSA-N
Synonyms

(1R5S)9nitro3(2(259trimethyl7oxo3phenyl7Hfuro(32g)chromen6yl)acetyl)3456tetrahydro1H15methanopyrido(12a)(15)diazocin8(2H)one
135638047
5nitro11(2(259trimethyl7oxo3phenylfuro(32g)chromen6yl)acetyl)711diazatricyclo(7310^(27))trideca24dien6one
9nitro3((259trimethyl7oxo3phenyl7Hfuro(32g)chromen6yl)acetyl)123456hexahydro8H15methanopyrido(12a)(15)diazocin8one
InChI=1SC33H29N3O7c11723122529(217546821)19(3)4231(25)18(2)30(23)4333(39)24(17)1328(37)3414201122(1634)2691027(36(40)41)32(38)35(26)1520h410122022H111316H213H3
MFCD31751780
O=C(N1C(C@@H)2C(C@@H)(C1)c1n(C2)c(=O)c(cc1)(N+)(=O)(O))Cc1c(=O)oc2c(c1C)cc1c(c2C)oc(c1c1ccccc1)C
ZINC001547206031

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Available files

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