Vitas-M small molecule compound
(8xi,9xi,14xi,17alpha)-3,14-dihydroxycard-20(22)-enolide
Catalog ID
STL564578
SMILES OC1CC[C@]2(C(C1)CCC1C2CC[C@]2(C1(O)CC[C@H]2C1=CC(=O)OC1)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 C23H34O4 MW 374.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C23H34O4/c1-21-8-5-16(24)12-15(21)3-4-19-18(21)6-9-22(2)17(7-10-23(19,22)26)14-11-20(25)27-13-14/h11,15-19,24,26H,3-10,12-13H2,1-2H3/t15?,16?,17-,18?,19?,21-,22+,23?/m0/s1InChIKey
XZTUSOXSLKTKJQ-GFOWPMLESA-NSynonyms
(8xi9xi14xi17alpha)314dihydroxycard20(22)enolide
145705516
3((10S13R17S)314dihydroxy1013dimethyl1234567891112151617tetradecahydrocyclopenta(a)phenanthren17yl)2Hfuran5one
4((3S5S8R10S13R14S17R)314dihydroxy1013dimethylhexadecahydro1Hcyclopenta(a)phenanthren17yl)furan2(5H)one
InChI=1SC23H34O4c1218516(24)1215(21)341918(21)6922(2)17(71023(1922)26)141120(25)271314h1115192426H3101213H212H3t15?16?1718?19?2122+23?m0s1
O(C@H)1CC(C@)2((C@H)(C1)CC(C@@H)1C2CC(C@)2((C@)1(O)CC(C@@H)2C1=CC(=O)OC1)C)C
ZINC000005535080
ZINC000255282708
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