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(3beta)-cholest-5-en-3-yl [(6-oxo-6H-benzo[c]chromen-3-yl)oxy]acetate

Catalog ID
STL459530
SMILES CC(CCC[C@H]([C@H]1CC[C@@H]2[C@]1(C)CC[C@H]1[C@H]2CC=C2[C@]1(C)CC[C@@H](C2)OC(=O)COc1ccc2c(c1)oc(=O)c1c2cccc1)C)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 C42H54O5 MW 638.89 g/mol Purity >90% as per NMR
InChI
InChI=1S/C42H54O5/c1-26(2)9-8-10-27(3)35-17-18-36-34-15-13-28-23-30(19-21-41(28,4)37(34)20-22-42(35,36)5)46-39(43)25-45-29-14-16-32-31-11-6-7-12-33(31)40(44)47-38(32)24-29/h6-7,11-14,16,24,26-27,30,34-37H,8-10,15,17-23,25H2,1-5H3/t27-,30+,34+,35-,36+,37+,
InChIKey
OIFDUXHQKJARTG-HSCMKLLHSA-N
Synonyms
1029130-85-5
((3S8S9S10R13R14S17R)1013dimethyl17((2R)6methylheptan2yl)234789111214151617dodecahydro1Hcyclopenta(a)phenanthren3yl)2(6oxobenzo(c)chromen3yl)oxyacetate
(3beta)cholest5en3yl((6oxo6Hbenzo(c)chromen3yl)oxy)acetate
(3S8S9S10R13R14S17R)1013dimethyl17((R)6methylheptan2yl)2347891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren3yl2((6oxo6Hbenzo(c)chromen3yl)oxy)acetate
1029130855
CC(C)CCCC(C)C1CCC2C1(CCC3C2CC=C4C3(CCC(C4)OC(=O)COC5=CC6=C(C=C5)C7=CC=CC=C7C(=O)O6)C)C
CC(CCC(C@H)((C@H)1CC(C@@H)2(C@)1(C)CC(C@H)1(C@H)2CC=C2(C@)1(C)CC(C@@H)(C2)OC(=O)COc1ccc2c(c1)oc(=O)c1c2cccc1)C)C
InChI=1SC42H54O5c126(2)981027(3)35171836341513282330(192141(284)37(34)202242(3536)5)4639(43)2545291416323111671233(31)40(44)4738(32)2429h67111416242627303437H81015172325H215H3t2730+34+3536+37+41+42m1s1
MFCD02058417
ZINC000079204297
ZINC79204297

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Available files

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