| SpectraBase Spectrum ID |
34g8RqMGVE |
| Name |
L-2-[(Benzyloxycarbonyl)amino]-4-(3-.beta.-acetyloxyepiandrost-16-en-17-yl)but-3-enoic acid |
| Alternate Name(s) |
(3E)-4-[(1S,2S,5R,10R,11S,15S)-5-(acetyloxy)-4-{[(benzyloxy)carbonyl]amino}-2,15-dimethyltetracyclo[8.7.0.0(2,7).0(11,15)]heptadec-13-en-14-yl]but-3-enoic acid |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C33H43NO6 |
| InChI |
InChI=1S/C33H43NO6/c1-21(35)40-29-18-24-12-14-25-26-15-13-23(10-7-11-30(36)37)32(26,2)17-16-27(25)33(24,3)19-28(29)34-31(38)39-20-22-8-5-4-6-9-22/h4-10,13,24-29H,11-12,14-20H2,1-3H3,(H,34,38)(H,36,37)/b10-7+/t24?,25-,26-,27-,28?,29+,32+,33-/m0/s1 |
| InChIKey |
JARRLDPHLBGUMO-JORLBOQUSA-N |
| Molecular Weight |
549.708 g/mol |
| SMILES |
OC(C\C=C\C1=CC[C@]2([C@]3([C@@]([C@]4(CC([C@@](CC4CC3)(OC(=O)C)[H])NC(=O)OCc3ccccc3)C)(CC[C@]12C)[H])[H])[H])=O |
| SPLASH |
splash10-0a4r-0502900000-d7ab4db2e12d109c2cc2 |
| Source of Spectrum |
F-48-3551-7 |
| Wiley ID |
1405594 |
![L-2-[(Benzyloxycarbonyl)amino]-4-(3-.beta.-acetyloxyepiandrost-16-en-17-yl)but-3-enoic acid](/api/spectrum/34g8RqMGVE/structure.png?h=300&w=458 "L-2-[(Benzyloxycarbonyl)amino]-4-(3-.beta.-acetyloxyepiandrost-16-en-17-yl)but-3-enoic acid")
