Vitas-M small molecule compound

24,24-diphenylchol-23-ene-3,12-diyl diacetate

Catalog ID
STK870277
SMILES CC(=O)OC1CC2C(C3C1(C)C(CC3)C(C/C=C(\c1ccccc1)/c1ccccc1)C)CCC1C2(C)CCC(C1)OC(=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 C40H52O4 MW 596.85 g/mol Purity >90% as per NMR
InChI
InChI=1S/C40H52O4/c1-26(16-18-33(29-12-8-6-9-13-29)30-14-10-7-11-15-30)35-20-21-36-34-19-17-31-24-32(43-27(2)41)22-23-39(31,4)37(34)25-38(40(35,36)5)44-28(3)42/h6-15,18,26,31-32,34-38H,16-17,19-25H2,1-5H3
InChIKey
PXGXVJQZVLXWGR-UHFFFAOYSA-N
Synonyms
53608-88-1
(12acetyloxy17(55diphenylpent4en2yl)1013dimethyl23456789111214151617tetradecahydro1Hcyclopenta(a)phenanthren3yl)acetate
2424diphenylchol23ene312diyldiacetate
53608881
CC(=O)OC1CC2C(C3C1(C)C(CC3)C(CC=C(c1ccccc1)c1ccccc1)C)CCC1C2(C)CCC(C1)OC(=O)C
CC(CC=C(C1=CC=CC=C1)C2=CC=CC=C2)C3CCC4C3(C(CC5C4CCC6C5(CCC(C6)OC(=O)C)C)OC(=O)C)C
InChI=1SC40H52O4c126(161833(29128691329)3014107111530)35202136341917312432(4327(2)41)222339(314)37(34)2538(40(3536)5)4428(3)42h615182631323438H16171925H215H3
MFCD18170079
ZINC000253497491
ZINC000253497494

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Available files

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