Vitas-M small molecule compound
(8xi,9xi,14xi,17xi)-3-[(2,6-dideoxy-3-O-methyl-D-ribo-hexopyranosyl)oxy]-5,14,19-trihydroxycard-20(22)-enolide
Catalog ID
STL564626
SMILES CO[C@H]1CC(OC2CC[C@]3(C(C2)(O)CCC2C3CC[C@]3(C2(O)CCC3C2=CC(=O)OC2)C)CO)O[C@@H]([C@H]1O)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 C30H46O9 MW 550.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C30H46O9/c1-17-26(33)23(36-3)13-25(38-17)39-19-4-9-28(16-31)21-5-8-27(2)20(18-12-24(32)37-15-18)7-11-30(27,35)22(21)6-10-29(28,34)14-19/h12,17,19-23,25-26,31,33-35H,4-11,13-16H2,1-3H3/t17-,19?,20?,21?,22?,23+,25?,26-,27-,28+,29?,30?/m1/s1InChIKey
WPKQVDYSPWCVGM-SMDKFTMYSA-NSynonyms
(8xi9xi14xi17xi)3((26dideoxy3OmethylDribohexopyranosyl)oxy)51419trihydroxycard20(22)enolide
145705524
3((10R13R)514dihydroxy3((4S5R6R)5hydroxy4methoxy6methyloxan2yl)oxy10(hydroxymethyl)13methyl23467891112151617dodecahydro1Hcyclopenta(a)phenanthren17yl)2Hfuran5one
4((3S5S8R9S10R13R14S17R)514dihydroxy3(((4S5R6R)5hydroxy4methoxy6methyltetrahydro2Hpyran2yl)oxy)10(hydroxymethyl)13methylhexadecahydro1Hcyclopenta(a)phenanthren17yl)furan2(5H)one
CO(C@H)1CC(O(C@H)2CC(C@)3((C@)(C2)(O)CC(C@@H)2(C@@H)3CC(C@)3((C@)2(O)CC(C@@H)3C2=CC(=O)OC2)C)CO)O(C@@H)((C@H)1O)C
InChI=1SC30H46O9c11726(33)23(363)1325(3817)39194928(1631)215827(2)20(181224(32)371518)71130(2735)22(21)61029(2834)1419h121719232526313335H4111316H213H3t1719?20?21?22?23+25?262728+29?30?m1s1
MFCD32651518
ZINC001848443738
ZINC001848443741
Check stock
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