| SpectraBase Spectrum ID |
9HOLwRsSxn1 |
| Name |
(4R)-4-[(3R,5R,8R,9S,10S,12S,13R,14S,17R)-10,13-dimethyl-3,12-bis[3-(4-nitrophenyl)-1-oxopropoxy]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid methyl ester |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C43H56N2O10 |
| InChI |
InChI=1S/C43H56N2O10/c1-27(5-20-39(46)53-4)35-18-19-36-34-17-12-30-25-33(54-40(47)21-10-28-6-13-31(14-7-28)44(49)50)23-24-42(30,2)37(34)26-38(43(35,36)3)55-41(48)22-11-29-8-15-32(16-9-29)45(51)52/h6-9,13-16,27,30,33-38H,5,10-12,17-26H2,1-4H3/t27-,30-,33-,34+,35-,36+,37+,38+,42+,43-/m1/s1 |
| InChIKey |
UGYIULSTTDLDQP-KOQFAZAZSA-N |
| Molecular Weight |
760.925 g/mol |
| SMILES |
[C@@]12([C@]([C@@]3(CC[C@]4([C@@]([C@]3(C[C@@]2(OC(=O)CCc2ccc(N(=O)=O)cc2)[H])[H])(CC[C@@](OC(=O)CCc2ccc(N(=O)=O)cc2)(C4)[H])C)[H])[H])(CC[C@@]1([C@@](CCC(=O)OC)(C)[H])[H])[H])C |
| SPLASH |
splash10-03di-1600000900-35e08a0812e434542bd9 |
| Source of Spectrum |
KC-0-85-2 |
| Synonyms |
(4R)-4-[(3R,5R,8R,9S,10S,12S,13R,14S,17R)-10,13-dimethyl-3,12-bis[3-(4-nitrophenyl)propanoyloxy]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]valeric acid methyl ester
Methyl (4R)-4-[(3R,5R,8R,9S,10S,12S,13R,14S,17R)-10,13-dimethyl-3,12-bis[3-(4-nitrophenyl)propanoyloxy]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoate |
| Wiley ID |
782890 |
![(4R)-4-[(3R,5R,8R,9S,10S,12S,13R,14S,17R)-10,13-dimethyl-3,12-bis[3-(4-nitrophenyl)-1-oxopropoxy]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid methyl ester](/api/spectrum/9HOLwRsSxn1/structure.png?h=300&w=458 "(4R)-4-[(3R,5R,8R,9S,10S,12S,13R,14S,17R)-10,13-dimethyl-3,12-bis[3-(4-nitrophenyl)-1-oxopropoxy]-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-17-yl]pentanoic acid methyl ester")
