InChI=1S/C23H34O4/c1-14(24)27-13-21(26)20-7-6-18-17-5-4-15-12-16(25)8-10-22(15,2)19(17)9-11-23(18,20)3/h4,16-20,25H,5-13H2,1-3H3/t16-,17-,18-,19-,20+,22-,23-/m0/s1

【InChIKey】

InChIKey=MDJRZSNPHZEMJH-MTMZYOSNSA-N

【SMILES】

CC(=O)OCC(=O)[C@H]1CC[C@@H]2[C@@]1(CC[C@H]3[C@H]2CC=C4[C@@]3(CC[C@@H](C4)O)C)C

【MOL File】

21-ACETOXYPREGNENOLO….mol

2Chemical and Physical Properties

【Computed Properties】

H bond donor:1

H bond acceptor:4

XLogP3:3.0

Bulk/Fine:F

3Material Safety Data Sheet(MSDS)

4CML File

21-ACETOXYPREGNENOLONE.cml

Quick Release

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566-78-9 21-ACETOXYPREGNENOLONE

1Identification

【Name】

【CAS】

【MDL】

【English Synonyms】

【Formula】

【MolWeight】

【Inchi】