CAS 3604-60-2 MFCD00083066-17-alpha-Pregn-5-en-20-yne-3-beta,17-beta-diol -LabNovo

SMILES: C#C[C@@]1(O)CC[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@@]21C

Mol. Formula	C21H30O2
Mol. Weight	314.466

Chemical Name	1-ethynyl-9a,11a-dimethyl-1H,2H,3H,3aH,3bH,4H,6H,7H,8H,9H,9aH,9bH,10H,11H,11aH-cyclopenta[a]phenanthrene-1,7-diol
Chemical Name Translation
InChIKey	VGJUOWGYQZYCII-TVWVXWENSA-N
LabNetwork Molecule ID	LN00845750
PubChem Substance ID	107424
InChI	InChI=1S/C21H30O2/c1-4-21(23)12-9-18-16-6-5-14-13-15(22)7-10-19(14,2)17(16)8-11-20(18,21)3/h1,5,15-18,22-23H,6-13H2,2-3H3/t15-,16+,17-,18-,19-,20-,21-/m0/s1
CAS Number	3604-60-2
MDL Number

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