| SpectraBase Spectrum ID |
1LBSgBKWAg |
| Name |
2.alpha.,3.beta.,4.alpha.,6.beta.,11,19-hexahydroxy-9,11-secocholest-(22E)-en-9-one (Euryspongiol A1) |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C27H46O7 |
| InChI |
InChI=1S/C27H46O7/c1-15(2)6-5-7-16(3)18-8-9-19(26(18,4)10-11-28)17-12-20(30)22-24(33)23(32)21(31)13-27(22,14-29)25(17)34/h5,7,15-24,28-33H,6,8-14H2,1-4H3/b7-5+/t16-,17?,18-,19+,20-,21-,22?,23+,24+,26-,27-/m1/s1 |
| InChIKey |
HJAVSBBNYZSZDJ-PLQLCKJASA-N |
| Molecular Weight |
482.658 g/mol |
| SMILES |
O[C@]1(C2[C@](CO)(C[C@]([C@@]1(O)[H])(O)[H])C(C(C[C@]2(O)[H])[C@]1([C@@]([C@]([C@@](\C=C\CC(C)C)(C)[H])([H])CC1)(CCO)C)[H])=O)[H] |
| SPLASH |
splash10-0ufr-9510000000-1fb44e7f1e081fb051c6 |
| Source of Spectrum |
F-50-3824-1 |
| Synonyms |
(3R,3aS,6aS,8R,9S,10S,11R,13aS)-3-[(1R,2E)-1,5-dimethyl-2-hexenyl]-5,8,9,10,11-pentahydroxy-6a-(hydroxymethyl)-3a-methylhexadecahydro-6H-benzo[a]cyclopenta[f]cyclodecen-6-one |
| Wiley ID |
1395649 |
