Vitas-M small molecule compound
(5alpha)-14-hydroxy-6-oxo-17-(prop-2-en-1-yl)-4,5-epoxymorphinan-3-yl tridecanoate
Catalog ID
STL553009
SMILES CCCCCCCCCCCCC(=O)Oc1ccc2c3c1OC1[C@@]43CCN(C(C2)[C@]4(O)CCC1=O)CC=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 C32H45NO5 MW 523.71 g/mol Purity >90% as per NMR
InChI
InChI=1S/C32H45NO5/c1-3-5-6-7-8-9-10-11-12-13-14-27(35)37-25-16-15-23-22-26-32(36)18-17-24(34)30-31(32,28(23)29(25)38-30)19-21-33(26)20-4-2/h4,15-16,26,30,36H,2-3,5-14,17-22H2,1H3/t26?,30?,31-,32+/m0/s1InChIKey
DUDUQJDKARDUEM-OOQFGOPWSA-NSynonyms
((4~(a)~(S)12~(b)~(S))4~(a)hydroxy7oxo3prop2enyl24567~(a)13hexahydro1~(H)412methanobenzofuro(32e)isoquinolin9yl)tridecanoate
(4R4aS7aR12bS)3allyl4ahydroxy7oxo2344a5677aoctahydro1H412methanobenzofuro(32e)isoquinolin9yltridecanoate
(5alpha)14hydroxy6oxo17(prop2en1yl)45epoxymorphinan3yltridecanoate
16397623
CCCCCCCCCCCCC(=O)Oc1ccc2c3c1OC1(C@@)43CCN(C(C2)(C@)4(O)CCC1=O)CC=C
InChI=1SC32H45NO5c1356789101112131427(35)3725161523222632(36)181724(34)3031(3228(23)29(25)3830)192133(26)2042h41516263036H235141722H21H3t26?30?3132+m0s1
ZINC000085893517
ZINC000085893521
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