Vitas-M small molecule compound

cholest-5-en-3-yl 2-(acetylamino)-2-deoxyhexopyranoside

Catalog ID
STL553684
SMILES OCC1OC(OC2CCC3(C(=CCC4C3CCC3(C4CCC3C(CCCC(C)C)C)C)C2)C)C(C(C1O)O)NC(=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 C35H59NO6 MW 589.86 g/mol Purity >90% as per NMR
InChI
InChI=1S/C35H59NO6/c1-20(2)8-7-9-21(3)26-12-13-27-25-11-10-23-18-24(14-16-34(23,5)28(25)15-17-35(26,27)6)41-33-30(36-22(4)38)32(40)31(39)29(19-37)42-33/h10,20-21,24-33,37,39-40H,7-9,11-19H2,1-6H3,(H,36,38)
InChIKey
DUJIJYKVZOZRHE-UHFFFAOYSA-N
Synonyms

~(N)(2((1013dimethyl17(6methylheptan2yl)234789111214151617dodecahydro1~(H)cyclopenta(a)phenanthren3yl)oxy)45dihydroxy6(hydroxymethyl)oxan3yl)acetamide
3835258
cholest5en3yl2(acetylamino)2deoxyhexopyranoside
InChI=1SC35H59NO6c120(2)87921(3)26121327251110231824(141634(235)28(25)151735(2627)6)413330(3622(4)38)32(40)31(39)29(1937)4233h1020212433373940H791119H216H3(H3638)
MFCD01333337
N((2R3R4R5S6R)2(((3S8S10R13R17R)1013dimethyl17((R)6methylheptan2yl)2347891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren3yl)oxy)45dihydroxy6(hydroxymethyl)tetrahydro2Hpyran3yl)acetamide
OC(C@H)1O(C@@H)(O(C@H)2CC(C@)3(C(=CC(C@@H)4C3CC(C@)3(C4CC(C@@H)3C(CCCC(C)C)C)C)C2)C)(C@@H)((C@H)((C@@H)1O)O)NC(=O)C
ZINC000504051770
ZINC000504051773

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Available files

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