Vitas-M small molecule compound
1-[(4aR,4bS,6aS,10aR,11aS,11bR)-2-hydroxy-4a,6a-dimethyl-1,2,3,4,4a,4b,5,6,6a,7,10,10a,11,11a,11b,12-hexadecahydro-6bH-indeno[2,1-a]phenanthren-6b-yl]ethanone
Catalog ID
STL527151
SMILES OC1CC[C@]2(C(=CC[C@@H]3[C@@H]2CC[C@]2([C@H]3C[C@@H]3C2(CC=CC3)C(=O)C)C)C1)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 C25H36O2 MW 368.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C25H36O2/c1-16(26)25-11-5-4-6-18(25)15-22-20-8-7-17-14-19(27)9-12-23(17,2)21(20)10-13-24(22,25)3/h4-5,7,18-22,27H,6,8-15H2,1-3H3/t18-,19?,20-,21+,22+,23+,24+,25?/m1/s1InChIKey
HVHYRVHDTSSVNF-MOUPPUJOSA-NSynonyms
1((4~(a)~(R)4~(b)~(S)6~(a)~(S)10~(a)~(R)11~(a)~(S)11~(b)~(R))2hydroxy4~(a)6~(a)dimethyl12344~(b)5671010~(a)1111~(a)11~(b)12tetradecahydroindeno(21a)phenanthren6~(b)yl)ethanone
1((4aR4bS6aS10aR11aS11bR)2hydroxy4a6adimethyl12344a4b566a71010a1111a11b12hexadecahydro6bHindeno(21a)phenanthren6byl)ethanone
1((4S6aR6bS8aS8bS12aR13aS13bR)4hydroxy6a8adimethyl34566a6b788a8b91212a1313a13bhexadecahydro1Hindeno(21a)phenanthren8byl)ethanone
135639232
InChI=1SC25H36O2c116(26)251154618(25)15222087171419(27)91223(172)21(20)101324(2225)3h457182227H6815H213H3t1819?2021+22+23+24+25?m1s1
MFCD03267811
O(C@H)1CC(C@)2(C(=CC(C@@H)3(C@@H)2CC(C@)2((C@H)3C(C@@H)3(C@)2(CC=CC3)C(=O)C)C)C1)C
ZINC000004081718
ZINC000005835153
Check stock
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Check stock on Vitas-MAvailable files
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