Vitas-M small molecule compound
(8xi,14xi,17xi,19E)-19-{[4-(furan-2-yl)butan-2-yl]imino}-3,5,14-trihydroxycard-20(22)-enolide
Catalog ID
STL526282
SMILES OC1CC[C@]2(C(C1)(O)CCC1[C@@H]2CC[C@]2(C1(O)CCC2C1=CC(=O)OC1)C)/C=N/C(CCc1ccco1)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 C31H43NO6 MW 525.69 g/mol Purity >90% as per NMR
InChI
InChI=1S/C31H43NO6/c1-20(5-6-23-4-3-15-37-23)32-19-29-12-7-22(33)17-30(29,35)13-9-26-25(29)8-11-28(2)24(10-14-31(26,28)36)21-16-27(34)38-18-21/h3-4,15-16,19-20,22,24-26,33,35-36H,5-14,17-18H2,1-2H3/b32-19+/t20?,22?,24?,25-,26?,28+,29-,30?,31?/m0/s1InChIKey
HYOVTNBCVIWXTH-UACNVLIPSA-NSynonyms
(8xi14xi17xi19E)19((4(furan2yl)butan2yl)imino)3514trihydroxycard20(22)enolide
4((3S5S8R9S10R13R14S17R)10((E)((4(furan2yl)butan2yl)imino)methyl)3514trihydroxy13methylhexadecahydro1Hcyclopenta(a)phenanthren17yl)furan2(5H)one
InChI=1SC31H43NO6c120(562343153723)32192912722(33)1730(2935)1392625(29)81128(2)24(101431(2628)36)211627(34)381821h3415161920222426333536H5141718H212H3b3219+t20?22?24?2526?28+2930?31?m0s1
MFCD02925698
O(C@H)1CC(C@)2((C@)(C1)(O)CC(C@@H)1(C@@H)2CC(C@)2((C@)1(O)CC(C@@H)2C1=CC(=O)OC1)C)C=NC(CCc1ccco1)C
ZINC000118931649
ZINC001772492033
Check stock
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