| SpectraBase Spectrum ID |
4PL7bbTfPq6 |
| Name |
3.alpha.,21.beta.-Diacetoxy-Gammaceran |
| Alternate Name(s) |
(3alpha,5alpha,8beta,9alpha,10beta,13beta,14alpha,17beta,18alpha,21beta)-3-(acetyloxy)gammaceran-21-yl acetate |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C34H56O4 |
| InChI |
InChI=1S/C34H56O4/c1-21(35)37-27-15-17-31(7)23(29(27,3)4)13-19-33(9)25(31)11-12-26-32(8)18-16-28(38-22(2)36)30(5,6)24(32)14-20-34(26,33)10/h23-28H,11-20H2,1-10H3/t23-,24-,25+,26+,27+,28+,31-,32-,33+,34+/m0/s1 |
| InChIKey |
JUTJEMCMYNNYFZ-LRKQPVBHSA-N |
| Molecular Weight |
528.818 g/mol |
| SMILES |
[C@@]12([C@]3([C@]([C@]4(CC[C@](C([C@@]4(CC3)[H])(C)C)(OC(=O)C)[H])C)([H])CC[C@@]1([C@]1(CC[C@](C([C@@]1(CC2)[H])(C)C)(OC(=O)C)[H])C)[H])C)C |
| SPLASH |
splash10-000i-0930200000-0d0f4b9820eed53e5287 |
| Source of Spectrum |
X2-57-765-0 |
| Wiley ID |
1605422 |
