| SpectraBase Spectrum ID |
DT6p3S1MYCm |
| Name |
ESTR-1-ENE-4.BETA.,5.BETA.-EPOXY-17.BETA.-OL-3-ONE |
| Copyright |
Copyright © 2011-2024 Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
288.172544630 u |
| Formula |
C18H24O3 |
| InChI |
InChI=1S/C18H24O3/c1-17-8-6-11-10(12(17)3-5-15(17)20)7-9-18-13(11)2-4-14(19)16(18)21-18/h2,4,10-13,15-16,20H,3,5-9H2,1H3/t10-,11+,12+,13-,15+,16+,17+,18-/m1/s1 |
| InChIKey |
OVRPQVINUMQNMU-XWLTYOAZSA-N |
| Molecular Weight |
288.387 g/mol |
| Nominal Mass |
288 u |
| Number of Peaks |
66 |
| SMILES |
O[C@]1(CC[C@]2([C@@]3(CC[C@@]45[C@](C(C=C[C@@]5([C@]3(CC[C@]12C)[H])[H])=O)(O4)[H])[H])[H])[H] |
| SPLASH |
splash10-000i-6690000000-ef9ab9b53245adbf3522 |
| Source File Reference |
LMCM-37243-140Q |
| Source of Spectrum |
Dr. Makin, London Hospital Medical College, UK |
| Synonyms |
7-HYDROXY-6A-METHYL-4A,4B,5,6,6A,7,8,9,9A,9B,10,11-DODECAHYDROCYCLOPENTA[7,8]PHENANTHRO[1,10A-B]OXIREN-2(1AH)-ONE |
| Wiley ID |
4_1916 |
