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(3beta)-cholest-5-en-3-yl [(4-methyl-6-oxo-6H-benzo[c]chromen-3-yl)oxy]acetate

Catalog ID
STL457398
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(c1C)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 C43H56O5 MW 652.91 g/mol Purity >90% as per NMR
InChI
InChI=1S/C43H56O5/c1-26(2)10-9-11-27(3)35-17-18-36-34-15-14-29-24-30(20-22-42(29,5)37(34)21-23-43(35,36)6)47-39(44)25-46-38-19-16-32-31-12-7-8-13-33(31)41(45)48-40(32)28(38)4/h7-8,12-14,16,19,26-27,30,34-37H,9-11,15,17-18,20-25H2,1-6H3/t27-,30+,34+,35-,36
InChIKey
VDLDQAOJUODQEB-FVQSQUBJSA-N
Synonyms
1038748-67-2
((3S8S9S10R13R14S17R)1013dimethyl17((2R)6methylheptan2yl)234789111214151617dodecahydro1Hcyclopenta(a)phenanthren3yl)2(4methyl6oxobenzo(c)chromen3yl)oxyacetate
(3beta)cholest5en3yl((4methyl6oxo6Hbenzo(c)chromen3yl)oxy)acetate
(3S8S9S10R13R14S17R)1013dimethyl17((R)6methylheptan2yl)2347891011121314151617tetradecahydro1Hcyclopenta(a)phenanthren3yl2((4methyl6oxo6Hbenzo(c)chromen3yl)oxy)acetate
1038748672
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(c1C)oc(=O)c1c2cccc1)C)C
CC1=C(C=CC2=C1OC(=O)C3=CC=CC=C23)OCC(=O)OC4CCC5(C6CCC7(C(C6CC=C5C4)CCC7C(C)CCCC(C)C)C)C
InChI=1SC43H56O5c126(2)1091127(3)35171836341514292430(202242(295)37(34)212343(3536)6)4739(44)2546381916323112781333(31)41(45)4840(32)28(38)4h78121416192627303437H9111517182025H216H3t2730+34+3536+37+42+43m1s1
MFCD02059436
ZINC000079204368
ZINC79204368

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Available files

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