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(1alpha,5xi,9xi,10xi,14alpha)-20-ethyl-1,16-dimethoxy-4-(methoxymethyl)aconitane-8,14-diol

Catalog ID
STL564683
SMILES COC[C@]12CC[C@@H]([C@@]34C2C[C@H](C3N(C1)CC)[C@@]1(C2C4C[C@@H]([C@@H]2O)[C@H](C1)OC)O)OC

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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 C24H39NO5 MW 421.58 g/mol Purity >90% as per NMR
InChI
InChI=1S/C24H39NO5/c1-5-25-11-22(12-28-2)7-6-18(30-4)24-14-8-13-16(29-3)10-23(27,19(14)20(13)26)15(21(24)25)9-17(22)24/h13-21,26-27H,5-12H2,1-4H3/t13-,14?,15+,16+,17?,18+,19?,20+,21?,22+,23+,24-/m1/s1
InChIKey
BDCURAWBZJMFIK-SAXGWMFCSA-N
Synonyms

(1alpha5xi9xi10xi14alpha)20ethyl116dimethoxy4(methoxymethyl)aconitane814diol
(1S4S5S6S8S9S13S16S)11ethyl616dimethoxy13(methoxymethyl)11azahexacyclo(772125011003801317)nonadecane48diol
(3S6S6aS7R7aR8S9S10S11aS12S14R)1ethyl610dimethoxy3(methoxymethyl)tetradecahydro1H36a12(epiethane(112)triyl)79methanonaphtho(23b)azocine811adiol
(3S6S6AS8S9S10S11AS12S)1ETHYL610DIMETHOXY3(METHOXYMETHYL)TETRADECAHYDRO1H36A12(EPIETHANE(112)TRIYL)79METHANONAPHTHO(23B)AZOCINE811ADIOL
16394640
COC(C@)12CC(C@@H)((C@@)34(C@@H)2C(C@@H)(C3N(C1)CC)(C@@)1((C@@H)2(C@H)4C(C@@H)((C@@H)2O)(C@H)(C1)OC)O)OC
InChI=1SC24H39NO5c15251122(12282)7618(304)241481316(293)1023(2719(14)20(13)26)15(21(24)25)917(22)24h13212627H512H214H3t1314?15+16+17?18+19?20+21?22+23+24m1s1
ZINC000100473559
ZINC000110257603

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Available files

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