Vitas-M small molecule compound
(11bR)-3',6',10,11b-tetramethyl-3-{[4,5,6-trihydroxy-3-(hydroxymethyl)tetrahydro-2H-pyran-2-yl]oxy}-2,3,3a',4,4',5',6,6',6a,6b,7,7',7a',8,11a,11b-hexadecahydro-3'H-spiro[benzo[a]fluorene-9,2'-furo[3,2-b]pyridin]-11(1H)-one (non-preferred name)
Catalog ID
STL564810
SMILES OCC1C(OC2CC[C@]3(C(=CCC4C3C(=O)C3=C(C)C5(CCC43)OC3C(C5C)NCC(C3)C)C2)C)OC(C(C1O)O)O
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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 C33H49NO8 MW 587.75 g/mol Purity >90% as per NMR
InChI
InChI=1S/C33H49NO8/c1-15-11-23-26(34-13-15)17(3)33(42-23)10-8-20-21-6-5-18-12-19(40-31-22(14-35)27(36)29(38)30(39)41-31)7-9-32(18,4)25(21)28(37)24(20)16(33)2/h5,15,17,19-23,25-27,29-31,34-36,38-39H,6-14H2,1-4H3/t15?,17?,19?,20?,21?,22?,23?,25?,26?,27?,29?InChIKey
WOWOEXHOMMENAS-OTVNCTJASA-NSynonyms
(11bR)361011btetramethyl3((456trihydroxy3(hydroxymethyl)tetrahydro2Hpyran2yl)oxy)233a445666a6b777a811a11bhexadecahydro3Hspiro(benzo(a)fluorene92furo(32b)pyridin)11(1H)one(nonpreferredname)
(11bR)361011btetramethyl3(456trihydroxy3(hydroxymethyl)oxan2yl)oxyspiro(123466a6b7811adecahydrobenzo(a)fluorene923a45677ahexahydro3Hfuro(32b)pyridine)11one
126961507
InChI=1SC33H49NO8c115112326(341315)17(3)33(4223)108202165181219(403122(1435)27(36)29(38)30(39)4131)7932(184)25(21)28(37)24(20)16(33)2h5151719232527293134363839H614H214H3t15?17?19?20?21?22?23?25?26?27?29?30?31?3233?m0s1
OC(C@H)1(C@@H)(O(C@H)2CC(C@)3(C(=CCC4C3C(=O)C3=C(C)(C@)5(CCC43)O(C@H)3(C@H)((C@H)5C)NC(C@H)(C3)C)C2)C)O(C@@H)((C@H)((C@H)1O)O)O
ZINC000245297697
ZINC000245297710
Check stock
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Check stock on Vitas-MAvailable files
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