Vitas-M small molecule compound
3-[(6-deoxy-3-O-methylhexopyranosyl)oxy]-14,16-dihydroxycard-20(22)-enolide
Catalog ID
STL566049
SMILES COC1C(O)C(OC2CCC3(C(C2)CCC2C3CCC3(C2(O)CC(C3C2=CC(=O)OC2)O)C)C)OC(C1O)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/c1-15-24(33)26(36-4)25(34)27(38-15)39-18-7-9-28(2)17(12-18)5-6-20-19(28)8-10-29(3)23(16-11-22(32)37-14-16)21(31)13-30(20,29)35/h11,15,17-21,23-27,31,33-35H,5-10,12-14H2,1-4H3InChIKey
CPFNIKYEDJFRAT-UHFFFAOYSA-NSynonyms
12443091
3((6deoxy3Omethylhexopyranosyl)oxy)1416dihydroxycard20(22)enolide
3(3(35dihydroxy4methoxy6methyloxan2yl)oxy1416dihydroxy1013dimethyl1234567891112151617tetradecahydrocyclopenta(a)phenanthren17yl)2Hfuran5one
4((10S13R)3(((2R3R4S5S6R)35dihydroxy4methoxy6methyltetrahydro2Hpyran2yl)oxy)1416dihydroxy1013dimethylhexadecahydro1Hcyclopenta(a)phenanthren17yl)furan2(5H)one
CO(C@@H)1(C@@H)(O)(C@H)(OC2CC(C@)3(C(C2)CCC2C3CC(C@)3(C2(O)CC(C3C2=CC(=O)OC2)O)C)C)O(C@@H)((C@@H)1O)C
InChI=1SC30H46O9c11524(33)26(364)25(34)27(3815)39187928(2)17(1218)562019(28)81029(3)23(161122(32)371416)21(31)1330(2029)35h111517212327313335H5101214H214H3
MFCD32651823
ZINC000257398240
ZINC000257398243
Check stock
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Check stock on Vitas-MAvailable files
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