Cas no 30655-78-8 ((2S,3R,5R,9R,10R,14S,17S)-2,3-Dihydroxy-10,14-dimethyl-17-[(2R,3R)-2,3,6-trihydroxy-6-methylheptan-2-yl]-1,2,3,4,5,9,11,15,16,17-decahydrocyclopenta[a]phenanthren-6-one)

(2S,3R,5R,9R,10R,14S,17S)-2,3-Dihydroxy-10,14-dimethyl-17-[(2R,3R)-2,3,6-trihydroxy-6-methylheptan-2-yl]-1,2,3,4,5,9,11,15,16,17-decahydrocyclopenta[a]phenanthren-6-one structure
30655-78-8 structure
Product Name:(2S,3R,5R,9R,10R,14S,17S)-2,3-Dihydroxy-10,14-dimethyl-17-[(2R,3R)-2,3,6-trihydroxy-6-methylheptan-2-yl]-1,2,3,4,5,9,11,15,16,17-decahydrocyclopenta[a]phenanthren-6-one
CAS No:30655-78-8
MF:C27H42O6
MW:462.618789196014
CID:318111
Update Time:2024-02-29

(2S,3R,5R,9R,10R,14S,17S)-2,3-Dihydroxy-10,14-dimethyl-17-[(2R,3R)-2,3,6-trihydroxy-6-methylheptan-2-yl]-1,2,3,4,5,9,11,15,16,17-decahydrocyclopenta[a]phenanthren-6-one Chemical and Physical Properties

Names and Identifiers

    • 18-Norcholesta-7,12-dien-6-one,2,3,20,22,25-pentahydroxy-14-methyl-, (2b,3b,5b,14b,22R)-
    • (14β,22R)-2β,3β,20,22,25-Pentahydroxy-14-methyl-18-nor-5β-cholesta-7,12-dien-6-one
    • 18-Nor-5b,14b-cholesta-7,12-dien-6-one, 2b,3b,20,22,25-pentahydroxy-14-methyl-, (22R)- (8CI)
    • Stachysteron A
    • Stachysterone A
    • (2S,3R,5R,9R,10R,14S,17S)-2,3-Dihydroxy-10,14-dimethyl-17-[(2R,3R)-2,3,6-trihydroxy-6-methylheptan-2
    • (2S,3R,5R,9R,10R,14S,17S)-2,3-Dihydroxy-10,14-dimethyl-17-[(2R,3R)-2,3,6-trihydroxy-6-methylheptan-2-yl]-1,2,3,4,5,9,11,15,16,17-decahydrocyclopenta[a]phenanthren-6-one
    • Inchi： 1S/C27H42O6/c1-24(2,32)10-9-23(31)27(5,33)17-8-11-25(3)15(17)6-7-16-18(25)12-20(28)19-13-21(29)22(30)14-26(16,19)4/h6,12,16-17,19,21-23,29-33H,7-11,13-14H2,1-5H3/t16-,17-,19-,21+,22-,23+,25-,26+,27+/m0/s1
    • InChI Key： DSUMGVHMUUADBM-VXUDCIMKSA-N
    • SMILES： O[C@@H]1[C@@H](C[C@H]2C(C=C3[C@@]4(C)CC[C@H]([C@](C)([C@@H](CCC(C)(C)O)O)O)C4=CC[C@@H]3[C@@]2(C)C1)=O)O

Computed Properties

  • Hydrogen Bond Donor Count: 5
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 33
  • Rotatable Bond Count: 5
  • Complexity: 876
  • Topological Polar Surface Area: 118

(2S,3R,5R,9R,10R,14S,17S)-2,3-Dihydroxy-10,14-dimethyl-17-[(2R,3R)-2,3,6-trihydroxy-6-methylheptan-2-yl]-1,2,3,4,5,9,11,15,16,17-decahydrocyclopenta[a]phenanthren-6-one Related Literature

Related Categories

30655-78-8 ((2S,3R,5R,9R,10R,14S,17S)-2,3-Dihydroxy-10,14-dimethyl-17-[(2R,3R)-2,3,6-trihydroxy-6-methylheptan-2-yl]-1,2,3,4,5,9,11,15,16,17-decahydrocyclopenta[a]phenanthren-6-one) Related Products

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