Vitas-M small molecule compound
N-[(11S)-1,2,3,4,5,6,7,8,9,10-decahydro-5,9-methanobenzo[8]annulen-11-yl]-3-(3-hydroxy-6-methyl-4-oxo-4H-pyran-2-yl)-3-(4-methoxyphenyl)propanamide
Catalog ID
STL552271
SMILES COc1ccc(cc1)C(c1oc(C)cc(=O)c1O)CC(=O)N[C@H]1C2CCCC1C1=C(C2)CCCC1
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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 C29H35NO5 MW 477.60 g/mol Purity >90% as per NMR
InChI
InChI=1S/C29H35NO5/c1-17-14-25(31)28(33)29(35-17)24(18-10-12-21(34-2)13-11-18)16-26(32)30-27-20-7-5-9-23(27)22-8-4-3-6-19(22)15-20/h10-14,20,23-24,27,33H,3-9,15-16H2,1-2H3,(H,30,32)/t20?,23?,24?,27-/m0/s1InChIKey
SRRDCPSCIWHXGD-UAFIWSKHSA-NSynonyms
135640536
3(3hydroxy6methyl4oxopyran2yl)3(4methoxyphenyl)~(N)((13~(S))13tricyclo(7310^(27))tridec2(7)enyl)propanamide
COc1ccc(cc1)C(c1oc(C)cc(=O)c1O)CC(=O)N(C@H)1C2CCCC1C1=C(C2)CCCC1
InChI=1SC29H35NO5c1171425(31)28(33)29(3517)24(18101221(342)131118)1626(32)30272075923(27)22843619(22)1520h10142023242733H391516H212H3(H3032)t20?23?24?27m0s1
N((11S)12345678910decahydro59methanobenzo(8)annulen11yl)3(3hydroxy6methyl4oxo4Hpyran2yl)3(4methoxyphenyl)propanamide
ZINC001547139550
ZINC001547139551
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