| SpectraBase Spectrum ID |
Bc7AAPrFnvb |
| Name |
(+-)-(1a.alpha.,2a.alpha.,3.beta.,8.beta.,8a.alpha.,9.alpha.,9a.alpha.)-2a,3,8,8a,9,9a-hexahydro-9-hydroxy-3,8[1',2']-benzonoanthra[2,3-b]oxiren-2(1aH)-one |
| Alternate Name(s) |
(+,-)-(1aa,2ab,3b,8b,8ab,9a,9aa)-2a,3,8,8a,9,9a-hexahydro-9-hydroxy-3,8[1',2']-benzenoanthra[2,3-b]oxiren-2(1aH)-one
(2R,4S,6S,7R,8R)-7-hydroxy-5-oxahexacyclo[7.6.6.0(2,8).0(4,6).0(10,15).0(16,21)]henicosa-10,12,14,16,18,20-hexaen-3-one |
| Comments |
Less than 3 mono-isotopic peaks |
| Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
| Formula |
C20H16O3 |
| InChI |
InChI=1S/C20H16O3/c21-17-15-13-9-5-1-2-6-10(9)14(12-8-4-3-7-11(12)13)16(15)18(22)20-19(17)23-20/h1-8,13-17,19-21H/t13-,14-,15-,16-,17-,19+,20-/m1/s1 |
| InChIKey |
NIKAPLNEORYUPS-AFHPCAKNSA-N |
| Molecular Weight |
304.345 g/mol |
| SMILES |
O[C@]1([C@]2([C@](O2)(C([C@@]2([C@]3(c4ccccc4[C@]([C@@]12[H])(c1ccccc31)[H])[H])[H])=O)[H])[H])[H] |
| SPLASH |
splash10-004i-0901000000-1e44fa04f3a5106654d0 |
| Source of Spectrum |
B-44-61-0 |
| Wiley ID |
1306791 |
![(+-)-(1a.alpha.,2a.alpha.,3.beta.,8.beta.,8a.alpha.,9.alpha.,9a.alpha.)-2a,3,8,8a,9,9a-hexahydro-9-hydroxy-3,8[1',2']-benzonoanthra[2,3-b]oxiren-2(1aH)-one](/api/spectrum/Bc7AAPrFnvb/structure.png?h=300&w=458 "(+-)-(1a.alpha.,2a.alpha.,3.beta.,8.beta.,8a.alpha.,9.alpha.,9a.alpha.)-2a,3,8,8a,9,9a-hexahydro-9-hydroxy-3,8[1',2']-benzonoanthra[2,3-b]oxiren-2(1aH)-one")
