Chemical ID: 5578482

CC12CCCC1C3CCC4CC(CCC4(C3CC2)C)O
Chemical ID:
5578482
Name [?]:
10,13-dimethyl-2,3,4,5,6,7,8,9,11,12,14,15,16,17-tetradecahydro-1H-cyclopenta[a]phenanthren-3-ol
SMILES [?]:
CC12CCCC1C3CCC4CC(CCC4(C3CC2)C)O
InChi [?]:
InChI=1/C19H32O/c1-18-9-3-4-16(18)15-6-5-13-12-14(20)7-11-19(13,2)17(15)8-10-18/h13-17,20H,3-12H2,1-2H3
InChi Info:
AuxInfo=1/0/N:1,19,4,5,9,8,13,17,3,18,14,11,10,12,7,6,16,2,15,20/rA:20cCCCCCCCCCCCCCCCCCCCO/rB:s1;s2;s3;s4;s2s5;s6;s7;s8;s9;s10;s11;s12;s13;s10s14;s7s15;s16;s2s17;s15;s12;/rC:;;;;;;;;;;;;;;;;;;;;

Chemical Details

Atom Count
Formula:C19H32O
All Atoms:20
Heavy Atoms:20
Chiral Atoms:7
ZAP Information [?]
Total:9.43496
Area:432.661
Solvation:-1.38157
Coulombic:-19.9454
Bond Count [?]
All:23
Single:23
Double:0
Rotors:0
Chiral:0
Rigid Segments:1
Chemical Properties
Molecular Weight:276.457
H-Bond Donors:1
H-Bond Acceptors:1
XLogP:5.94
LogP (Chemaxon):4.64

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Descriptor Annotations

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