Vitas-M small molecule compound
(17R)-2'-ethoxy-11-hydroxy-2',10,13-trimethyl-7,8,9,10,11,12,13,14,15,16-decahydro-5'H-spiro[cyclopenta[a]phenanthrene-17,4'-[1,3]dioxane]-3,5'(6H)-dione
Catalog ID
STL171339
SMILES CCOC1(C)OCC(=O)[C@@]2(O1)CCC1C2(C)CC(O)C2C1CCC1=CC(=O)C=CC21C
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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 C25H34O6 MW 430.54 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H34O6/c1-5-29-24(4)30-14-20(28)25(31-24)11-9-18-17-7-6-15-12-16(26)8-10-22(15,2)21(17)19(27)13-23(18,25)3/h8,10,12,17-19,21,27H,5-7,9,11,13-14H2,1-4H3/t17?,18?,19?,21?,22?,23?,24?,25-/m0/s1InChIKey
NJHZLTMLCXGLPG-BZMRRLSBSA-NSynonyms
(17R)2ethoxy11hydroxy21013trimethyl78910111213141516decahydro5Hspiro(cyclopenta(a)phenanthrene174(13)dioxane)35(6H)dione
(4R)2ethoxy11hydroxy21013trimethylspiro(13dioxane4177891112141516octahydro6Hcyclopenta(a)phenanthrene)35dione
CCOC1(C)OCC(=O)(C@@)2(O1)CCC1C2(C)CC(O)C2C1CCC1=CC(=O)C=CC21C
CCOC1(OCC(=O)C2(O1)CCC3C2(CC(C4C3CCC5=CC(=O)C=CC45C)O)C)C
InChI=1SC25H34O6c152924(4)301420(28)25(3124)119181776151216(26)81022(152)21(17)19(27)1323(1825)3h8101217192127H579111314H214H3t17?18?19?21?22?23?24?25m0s1
MFCD01450041
ZINC000253504052
ZINC000253504064
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