NSC 48010
CAS Registry Number®
6638-25-1
CAS Name
NSC 48010Molecular Formula
C21H26O4SMolecular Mass
374.49Cite this Page
NSC 48010. CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=6638-25-1 (retrieved ) (CAS RN: 6638-25-1). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C21H26O4S/c1-12(22)25-14-8-9-20(3)13(10-14)4-5-16-15-6-7-17(23)19(15,2)11-18(24)21(16,20)26/h4,10,15-16,26H,5-9,11H2,1-3H3/t15-,16-,19-,20-,21-/m0/s1
InChIKey
InChIKey=AQIYOMKPFQCODB-NHUSPQTBSA-N
SMILES
S[C@@]12[C@]3(C)C(C=C(OC(C)=O)CC3)=CC[C@]1([C@]4([C@](C)(CC2=O)C(=O)CC4)[H])[H]
Canonical SMILES
O=C(OC1=CC2=CCC3C4CCC(=O)C4(C)CC(=O)C3(S)C2(C)CC1)C
Other Names for this Substance
- Androsta-3,5-diene-11,17-dione, 3-(acetyloxy)-9-mercapto-
- NSC 48010