Vitas-M small molecule compound
(6aR,6bS,8S,11S,11aS,12S)-3-chloro-12-(phenylcarbonyl)-6a,6b,10,11,11a,12-hexahydro-8,11-epoxyoxepino[4',5':3,4]pyrrolo[1,2-a]quinolin-7(8H)-one
Catalog ID
STL524518
SMILES O=C1[C@H]2OC[C@H](O2)[C@H]2[C@H]1[C@H]1C=Cc3c(N1[C@@H]2C(=O)c1ccccc1)ccc(c3)Cl
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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 C23H18ClNO4 MW 407.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H18ClNO4/c24-14-7-9-15-13(10-14)6-8-16-18-19(17-11-28-23(29-17)22(18)27)20(25(15)16)21(26)12-4-2-1-3-5-12/h1-10,16-20,23H,11H2/t16-,17-,18-,19+,20+,23+/m1/s1InChIKey
NSDGRSXHJPOKID-PXMUBOSUSA-NSynonyms
956813-24-4(1~(S)2~(S)3~(S)13~(R)14~(S)16~(S))3benzoyl8chloro1719dioxa4azapentacyclo(14210^(214)0^(413)0^(510))nonadeca5(10)6811tetraen15one
(6aR6bR8R11S11aR12S)12benzoyl3chloro6b8101111a12hexahydro811epoxyoxepino(4534)pyrrolo(12a)quinolin7(6aH)one
(6aR6bS8S11S11aS12S)3chloro12(phenylcarbonyl)6a6b101111a12hexahydro811epoxyoxepino(4534)pyrrolo(12a)quinolin7(8H)one
16396023
956813244
InChI=1SC23H18ClNO4c2414791513(1014)68161819(17112823(2917)22(18)27)20(25(15)16)21(26)124213512h110162023H11H2t16171819+20+23+m1s1
MFCD01547383
O=C1(C@H)2OC(C@@H)(O2)(C@H)2(C@H)1(C@H)1C=Cc3c(N1(C@@H)2C(=O)c1ccccc1)ccc(c3)Cl
ZINC000100742767
ZINC100742767
Check stock
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Check stock on Vitas-MAvailable files
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