Vitas-M small molecule compound
(5xi,9xi,13xi,17xi,18xi)-19,28-epoxyoleanane-3,28-dione
Catalog ID
STL564829
SMILES O=C1CC[C@]2(C(C1(C)C)CC[C@@]1(C2CCC2[C@@]1(C)CCC13C2C(OC3=O)C(C)(C)CC1)C)C
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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 C30H46O3 MW 454.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H46O3/c1-25(2)14-16-30-17-15-28(6)18(22(30)23(25)33-24(30)32)8-9-20-27(5)12-11-21(31)26(3,4)19(27)10-13-29(20,28)7/h18-20,22-23H,8-17H2,1-7H3/t18?,19?,20?,22?,23?,27-,28+,29+,30?/m0/s1InChIKey
NJVHLJAPSJFFSB-MFEMRDSTSA-NSynonyms
(1R4aR6aR6bR12aR14aR14bR)226a6b9912aheptamethyloctadecahydro1H14a(epoxymethano)picene1015(2H)dione
(4R5R13R)4599132020heptamethyl24oxahexacyclo(17320118041705140813)tetracosane1023dione
(5xi9xi13xi17xi18xi)1928epoxyoleanane328dione
20975226
InChI=1SC30H46O3c125(2)141630171528(6)18(22(30)23(25)3324(30)32)892027(5)121121(31)26(34)19(27)101329(2028)7h18202223H817H217H3t18?19?20?22?23?2728+29+30?m0s1
O=C1CC(C@)2(C(C1(C)C)CC(C@@)1(C2CC(C@H)2(C@@)1(C)CC(C@)13(C@@H)2(C@@H)(OC3=O)C(C)(C)CC1)C)C
ZINC000102946841
ZINC000253388628
Check stock
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