Vitas-M small molecule compound
2-{4-[(16E)-5-hydroxy-8-methyl-2,6,12-trioxo-3,4,8,9,10,11,12,13,14,15-decahydro-2H,6H-oxacyclotetradecino[3,4-g]chromen-4-yl]phenoxy}acetamide
Catalog ID
STL538534
SMILES NC(=O)COc1ccc(cc1)C1CC(=O)Oc2c1c(O)c1c(c2)/C=C/CCCC(=O)CCCC(OC1=O)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 C29H31NO8 MW 521.57 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H31NO8/c1-17-6-5-9-20(31)8-4-2-3-7-19-14-23-27(28(34)26(19)29(35)37-17)22(15-25(33)38-23)18-10-12-21(13-11-18)36-16-24(30)32/h3,7,10-14,17,22,34H,2,4-6,8-9,15-16H2,1H3,(H2,30,32)/b7-3+InChIKey
KBQNUFNFMJFKDJ-XVNBXDOJSA-NSynonyms
2(4((12~(E))22hydroxy4methyl2818trioxo317dioxatricyclo(12800^(1621))docosa1(22)121416(21)tetraen20yl)phenoxy)acetamide
2(4((16E)5hydroxy8methyl2612trioxo3489101112131415decahydro2H6Hoxacyclotetradecino(34g)chromen4yl)phenoxy)acetamide
2(4((8SE)5hydroxy8methyl2612trioxo234689101112131415dodecahydro(1)oxacyclotetradecino(34g)chromen4yl)phenoxy)acetamide
71754394
InChI=1SC29H31NO8c11765920(31)8423719142327(28(34)26(19)29(35)3717)22(1525(33)3823)18101221(131118)361624(30)32h371014172234H246891516H21H3(H23032)b73+
MFCD22574731
NC(=O)COc1ccc(cc1)C1CC(=O)Oc2c1c(O)c1c(c2)C=CCCCC(=O)CCC(C@@H)(OC1=O)C
ZINC000254749973
ZINC000254749985
Check stock
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