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(6R,6aS)-N-[2-(1H-indol-3-yl)ethyl]-3-nitro-10-oxo-6,6a,7,8,14,15-hexahydro-5H,10H-7,14-methanopyrido[1',2':5,6][1,5]diazocino[1,2-a]quinoline-6-carboxamide

Catalog ID
STL550199
SMILES O=C([C@@H]1Cc2cc(ccc2N2[C@H]1[C@H]1C[C@@H](C2)c2n(C1)c(=O)ccc2)[N+](=O)[O-])NCCc1c[nH]c2c1cccc2

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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 C30H29N5O4 MW 523.59 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H29N5O4/c36-28-7-3-6-26-20-12-21(17-33(26)28)29-24(14-19-13-22(35(38)39)8-9-27(19)34(29)16-20)30(37)31-11-10-18-15-32-25-5-2-1-4-23(18)25/h1-9,13,15,20-21,24,29,32H,10-12,14,16-17H2,(H,31,37)/t20?,21?,24-,29+/m1/s1
InChIKey
ADPMDMIGEWKQSZ-UANMNCAQSA-N
Synonyms

(2~(S)3~(R))~(N)(2(1~(H)indol3yl)ethyl)7nitro18oxo1119diazapentacyclo(11710^(211)0^(510)0^(1419))henicosa5(10)681416pentaene3carboxamide
(6R6aS)N(2(1Hindol3yl)ethyl)3nitro10oxo566a78101415octahydro714methanopyrido(1256)(15)diazocino(12a)quinoline6carboxamide
(6R6aS)N(2(1Hindol3yl)ethyl)3nitro10oxo66a781415hexahydro5H10H714methanopyrido(1256)(15)diazocino(12a)quinoline6carboxamide
127252605
InChI=1SC30H29N5O4c362873626201221(1733(26)28)2924(14191322(35(38)39)8927(19)34(29)1620)30(37)31111018153225521423(18)25h1913152021242932H1012141617H2(H3137)t20?21?2429+m1s1
O=C((C@@H)1Cc2cc(ccc2N2(C@H)1C1CC(C2)c2n(C1)c(=O)ccc2)(N+)(=O)(O))NCCc1c(nH)c2c1cccc2
ZINC001547138136

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Available files

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