Vitas-M small molecule compound

3,12-bis[3-(diethylamino)-2-hydroxypropyl]-3,12-diaza-6,9-diazoniadispiro[5.2.5.2]hexadecane

Catalog ID
STL059136
SMILES CCN(CC(CN1CC[N+]2(CC1)CC[N+]1(CC2)CCN(CC1)CC(CN(CC)CC)O)O)CC

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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 C26H56N6O2 MW 484.77 g/mol Purity >90% as per NMR
InChI
InChI=1S/C26H56N6O2/c1-5-27(6-2)21-25(33)23-29-9-13-31(14-10-29)17-19-32(20-18-31)15-11-30(12-16-32)24-26(34)22-28(7-3)8-4/h25-26,33-34H,5-24H2,1-4H3/q+2
InChIKey
OXSHNEQZRPBCFU-UHFFFAOYSA-N
Synonyms

1(DIETHYLAMINO)3(12(3(DIETHYLAMINO)2HYDROXYPROPYL)312DIAZA69DIAZONIADISPIRO(525(9)2(6))HEXADECAN3YL)PROPAN2OL
1(diethylamino)3(12(3(diethylamino)2hydroxypropyl)312diaza69diazoniadispiro(525^(9)2^(6))hexadecan3yl)propan2ol
312bis(3(diethylamino)2hydroxypropyl)312diaza69diazoniadispiro(5252)hexadecane
312bis(3(diethylamino)2hydroxypropyl)36$l^(5)9$l^(5)12tetraazadispiro(525^(9)2^(6))hexadecane69bis(ylium)trihydratedichloride
CCN(CC(CN1CC(N+)2(CC1)CC(N+)1(CC2)CCN(CC1)CC(CN(CC)CC)O)O)CC
CCN(CC(CN1CC(N+)2(CC1)CC(N+)1(CC2)CCN(CC1)CC(CN(CC)CC)O)O)CCOOO(Cl)(Cl)
CCN(CC)CC(CN1CC(N+)2(CC1)CC(N+)3(CCN(CC3)CC(CN(CC)CC)O)CC2)O
InChI=1SC26H56N6O2c1527(62)2125(33)232991331(141029)171932(201831)151130(121632)2426(34)2228(73)84h25263334H524H214H3q+2
ZINC000008926137
ZINC000008926303

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Available files

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