document.write('
516-16-5
5-ALPHA-PREGNAN-3-BETA, 11-BETA, 21-TRIOL-20-ONE
Name
5-ALPHA-PREGNAN-3-BETA, 11-BETA, 21-TRIOL-20-ONE
Formula
C21 H34 O4
MolWeight
350.496
1Identification
【Name】
5-ALPHA-PREGNAN-3-BETA, 11-BETA, 21-TRIOL-20-ONE
【CAS】
【MDL】
MFCD00069481
【English Synonyms】
【Formula】
C21 H34 O4
【MolWeight】
350.496
【Inchi】
InChI=1S/C21H34O4/c1-20-8-7-13(23)9-12(20)3-4-14-15-5-6-16(18(25)11-22)21(15,2)10-17(24)19(14)20/h12-17,19,22-24H,3-11H2,1-2H3/t12-,13-,14-,15-,16+,17-,19+,20-,21-/m0/s1
【InChIKey】
InChIKey=RHQQHZQUAMFINJ-GKWSUJDHSA-N
【SMILES】
C[C@]12CC[C@@H](C[C@@H]1CC[C@@H]3[C@@H]2[C@H](C[C@]4([C@H]3CC[C@@H]4C(=O)CO)C)O)O
【MOL File】
2Chemical and Physical Properties
【Computed Properties】
H bond donor:3
H bond acceptor:4
XLogP3:2.0
Bulk/Fine:F
3Material Safety Data Sheet(MSDS)
4CML File
5-ALPHA-PREGNAN-3-BETA, 11-BETA, 21-TRIOL-20-ONE.cml
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Business Type:Trading Company
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