Vitas-M small molecule compound
(3alpha,5xi,9xi,12beta,13xi,17xi,20R)-20,24-epoxydammarane-3,12,25-triol
Catalog ID
STL564534
SMILES O[C@@H]1CC2[C@@]3(C)CC[C@H](C(C3CC[C@]2([C@]2(C1C(CC2)[C@@]1(C)CCC(O1)C(O)(C)C)C)C)(C)C)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 C30H52O4 MW 476.74 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H52O4/c1-25(2)20-10-15-28(6)21(27(20,5)13-11-22(25)32)17-19(31)24-18(9-14-29(24,28)7)30(8)16-12-23(34-30)26(3,4)33/h18-24,31-33H,9-17H2,1-8H3/t18?,19-,20?,21?,22-,23?,24?,27+,28-,29-,30-/m1/s1InChIKey
DOAJFZJEGHSYOI-YUAKBPKHSA-NSynonyms
(3alpha5xi9xi12beta13xi17xi20R)2024epoxydammarane31225triol
(3R8R10R12R13R14R17S)17((2S5R)5(2hydroxypropan2yl)2methyltetrahydrofuran2yl)4481014pentamethylhexadecahydro1Hcyclopenta(a)phenanthrene312diol
(3R8R10R12R14R)17((2R)5(2hydroxypropan2yl)2methyloxolan2yl)4481014pentamethyl235679111213151617dodecahydro1Hcyclopenta(a)phenanthrene312diol
145705509
InChI=1SC30H52O4c125(2)20101528(6)21(27(205)131122(25)32)1719(31)2418(91429(2428)7)30(8)161223(3430)26(34)33h18243133H917H218H3t18?1920?21?2223?24?27+282930m1s1
O(C@@H)1CC2(C@@)3(C)CC(C@H)(C(C3CC(C@)2((C@)2((C@H)1(C@H)(CC2)(C@)1(C)CC(C@@H)(O1)C(O)(C)C)C)C)(C)C)O
ZINC001848443582
ZINC001848443585
Check stock
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Check stock on Vitas-MAvailable files
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