(5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,14,17-tetraene-8,16-dione;(5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,17-triene-8,16-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene]-8',16'-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene]-8',16'-dione;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene-20-carboxylate;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene-20-carboxylate

C142H158O16 — CID 158047944

IUPAC(5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,14,17-tetraene-8,16-dione;(5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,17-triene-8,16-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene]-8',16'-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene]-8',16'-dione;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene-20-carboxylate;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene-20-carboxylate
SMILESCC12C=CC(=O)C=C1C1(CC1)CC1=C2CCC23C(=O)CC[C@]2(C)CC=C13.CC12C=CC(=O)C=C1C1CC1C1=C2CCC23C(=O)CC[C@]2(C)CC=C13.CC12CCC(=O)C=C1C1(CC1)CC1=C2CCC23C(=O)CC[C@]2(C)CC=C13.CC12CCC(=O)C=C1C1CC1C1=C2CCC23C(=O)CC[C@]2(C)CC=C13.COC(=O)[C@@H]1CC2=CC(=O)C=CC2(C)C2=C1C1=CC[C@@]3(C)CCC(=O)C13CC2.COC(=O)[C@@H]1CC2=CC(=O)CCC2(C)C2=C1C1=CC[C@@]3(C)CCC(=O)C13CC2
InChIInChI=1S/C24H28O4.C24H26O4.C24H28O2.C24H26O2.C23H26O2.C23H24O2/c2*1-22-8-5-18-20-16(21(27)28-3)13-14-12-15(25)4-10-23(14,2)17(20)6-11-24(18,22)19(26)7-9-22;2*1-21-7-4-18-16-14-23(11-12-23)19-13-15(25)3-9-22(19,2)17(16)5-10-24(18,21)20(26)6-8-21;2*1-21-7-4-17-20-15-12-14(15)18-11-13(24)3-9-22(18,2)16(20)5-10-23(17,21)19(25)6-8-21/h5,12,16H,4,6-11,13H2,1-3H3;4-5,10,12,16H,6-9,11,13H2,1-3H3;4,13H,3,5-12,14H2,1-2H3;3-4,9,13H,5-8,10-12,14H2,1-2H3;4,11,14-15H,3,5-10,12H2,1-2H3;3-4,9,11,14-15H,5-8,10,12H2,1-2H3/t2*16-,22+,23?,24?;2*21-,22?,24?;2*14?,15?,21-,22?,23?/m110000/s1
InChIKeyFJDIGPBLANIFLV-INWHDVFMSA-N
MW2120.81 g/mol
LogP27.73
Rot. Bonds2

About (5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,14,17-tetraene-8,16-dione;(5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,17-triene-8,16-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene]-8',16'-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene]-8',16'-dione;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene-20-carboxylate;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene-20-carboxylate

(5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,14,17-tetraene-8,16-dione;(5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,17-triene-8,16-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene]-8',16'-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene]-8',16'-dione;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene-20-carboxylate;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene-20-carboxylate (PubChem CID 158047944) has the molecular formula C142H158O16 and a molecular weight of 2120.81 g/mol. Its IUPAC name is (5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,14,17-tetraene-8,16-dione;(5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,17-triene-8,16-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene]-8',16'-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene]-8',16'-dione;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene-20-carboxylate;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene-20-carboxylate.

Molecular Properties

Compound Name(5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,14,17-tetraene-8,16-dione;(5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,17-triene-8,16-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene]-8',16'-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene]-8',16'-dione;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene-20-carboxylate;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene-20-carboxylate
PubChem CID158047944
Molecular FormulaC142H158O16
Molecular Weight2120.81 g/mol
Exact Mass2119.15
IUPAC Name(5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,14,17-tetraene-8,16-dione;(5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,17-triene-8,16-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene]-8',16'-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene]-8',16'-dione;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene-20-carboxylate;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene-20-carboxylate
SMILESCC12C=CC(=O)C=C1C1(CC1)CC1=C2CCC23C(=O)CC[C@]2(C)CC=C13.CC12C=CC(=O)C=C1C1CC1C1=C2CCC23C(=O)CC[C@]2(C)CC=C13.CC12CCC(=O)C=C1C1(CC1)CC1=C2CCC23C(=O)CC[C@]2(C)CC=C13.CC12CCC(=O)C=C1C1CC1C1=C2CCC23C(=O)CC[C@]2(C)CC=C13.COC(=O)[C@@H]1CC2=CC(=O)C=CC2(C)C2=C1C1=CC[C@@]3(C)CCC(=O)C13CC2.COC(=O)[C@@H]1CC2=CC(=O)CCC2(C)C2=C1C1=CC[C@@]3(C)CCC(=O)C13CC2
InChIInChI=1S/C24H28O4.C24H26O4.C24H28O2.C24H26O2.C23H26O2.C23H24O2/c2*1-22-8-5-18-20-16(21(27)28-3)13-14-12-15(25)4-10-23(14,2)17(20)6-11-24(18,22)19(26)7-9-22;2*1-21-7-4-18-16-14-23(11-12-23)19-13-15(25)3-9-22(19,2)17(16)5-10-24(18,21)20(26)6-8-21;2*1-21-7-4-17-20-15-12-14(15)18-11-13(24)3-9-22(18,2)16(20)5-10-23(17,21)19(25)6-8-21/h5,12,16H,4,6-11,13H2,1-3H3;4-5,10,12,16H,6-9,11,13H2,1-3H3;4,13H,3,5-12,14H2,1-2H3;3-4,9,13H,5-8,10-12,14H2,1-2H3;4,11,14-15H,3,5-10,12H2,1-2H3;3-4,9,11,14-15H,5-8,10,12H2,1-2H3/t2*16-,22+,23?,24?;2*21-,22?,24?;2*14?,15?,21-,22?,23?/m110000/s1
InChIKeyFJDIGPBLANIFLV-INWHDVFMSA-N
XLogP27.73
TPSA257.44 Ų
H-Bond Donors
H-Bond Acceptors16
Rotatable Bonds2
Heavy Atoms158
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002120.81
LogP ≤ 527.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1016

Analyze (5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,14,17-tetraene-8,16-dione;(5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,17-triene-8,16-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene]-8',16'-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene]-8',16'-dione;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene-20-carboxylate;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene-20-carboxylate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(5R,9R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,17-triene-8,16-dione
CID 59086354
(5S,13R,20S)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene-20-carboxylic acid
CID 70145554
(5R,9R,20R)-N,N,5,13-tetramethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene-20-carboxamide
CID 59047551
propan-2-yl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene-20-carboxylate;propyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene-20-carboxylate;bis((5R,20R)-5,13,20-trimethylpentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene-8,16-dione)
CID 159154368
ethoxymethoxyethane;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene-20-carboxylate;methyl (5R,20R)-16-ethoxy-5,13-dimethyl-8-oxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,16,18-tetraene-20-carboxylate;methyl (5R,20S)-19-hydroxy-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene-20-carboxylate
CID 159330903
(5R)-5,13-dimethylpentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene-8,16-dione
CID 59086393
2-methylpropyl (5R,9R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,18-triene-20-carboxylate
CID 91247514
propyl (5R,9R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,18-triene-20-carboxylate
CID 90748115
butan-2-yl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,18-triene-20-carboxylate
CID 91165403
(5R,9R,20R)-N,N,5,13-tetramethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,18-triene-20-carboxamide
CID 90703493
butyl (5R,9R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,18-triene-20-carboxylate
CID 91181292
butyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,18-triene-20-carboxylate
CID 91608452

Frequently Asked Questions

What is the IUPAC name of (5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,14,17-tetraene-8,16-dione;(5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,17-triene-8,16-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene]-8',16'-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene]-8',16'-dione;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene-20-carboxylate;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene-20-carboxylate?
The IUPAC name of (5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,14,17-tetraene-8,16-dione;(5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,17-triene-8,16-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene]-8',16'-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene]-8',16'-dione;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene-20-carboxylate;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene-20-carboxylate (CID 158047944) is (5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,14,17-tetraene-8,16-dione;(5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,17-triene-8,16-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene]-8',16'-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene]-8',16'-dione;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene-20-carboxylate;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene-20-carboxylate.
What is the SMILES notation for (5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,14,17-tetraene-8,16-dione;(5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,17-triene-8,16-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene]-8',16'-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene]-8',16'-dione;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene-20-carboxylate;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene-20-carboxylate?
The canonical SMILES for (5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,14,17-tetraene-8,16-dione;(5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,17-triene-8,16-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene]-8',16'-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene]-8',16'-dione;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene-20-carboxylate;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene-20-carboxylate is CC12C=CC(=O)C=C1C1(CC1)CC1=C2CCC23C(=O)CC[C@]2(C)CC=C13.CC12C=CC(=O)C=C1C1CC1C1=C2CCC23C(=O)CC[C@]2(C)CC=C13.CC12CCC(=O)C=C1C1(CC1)CC1=C2CCC23C(=O)CC[C@]2(C)CC=C13.CC12CCC(=O)C=C1C1CC1C1=C2CCC23C(=O)CC[C@]2(C)CC=C13.COC(=O)[C@@H]1CC2=CC(=O)C=CC2(C)C2=C1C1=CC[C@@]3(C)CCC(=O)C13CC2.COC(=O)[C@@H]1CC2=CC(=O)CCC2(C)C2=C1C1=CC[C@@]3(C)CCC(=O)C13CC2.
What is the InChIKey of (5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,14,17-tetraene-8,16-dione;(5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,17-triene-8,16-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene]-8',16'-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene]-8',16'-dione;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene-20-carboxylate;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene-20-carboxylate?
The InChIKey is FJDIGPBLANIFLV-INWHDVFMSA-N. The full InChI is InChI=1S/C24H28O4.C24H26O4.C24H28O2.C24H26O2.C23H26O2.C23H24O2/c2*1-22-8-5-18-20-16(21(27)28-3)13-14-12-15(25)4-10-23(14,2)17(20)6-11-24(18,22)19(26)7-9-22;2*1-21-7-4-18-16-14-23(11-12-23)19-13-15(25)3-9-22(19,2)17(16)5-10-24(18,21)20(26)6-8-21;2*1-21-7-4-17-20-15-12-14(15)18-11-13(24)3-9-22(18,2)16(20)5-10-23(17,21)19(25)6-8-21/h5,12,16H,4,6-11,13H2,1-3H3;4-5,10,12,16H,6-9,11,13H2,1-3H3;4,13H,3,5-12,14H2,1-2H3;3-4,9,13H,5-8,10-12,14H2,1-2H3;4,11,14-15H,3,5-10,12H2,1-2H3;3-4,9,11,14-15H,5-8,10,12H2,1-2H3/t2*16-,22+,23?,24?;2*21-,22?,24?;2*14?,15?,21-,22?,23?/m110000/s1.
What are the key properties of (5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,14,17-tetraene-8,16-dione;(5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,17-triene-8,16-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene]-8',16'-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene]-8',16'-dione;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene-20-carboxylate;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene-20-carboxylate?
(5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,14,17-tetraene-8,16-dione;(5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,17-triene-8,16-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene]-8',16'-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene]-8',16'-dione;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene-20-carboxylate;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene-20-carboxylate has a molecular weight of 2120.81 g/mol, XLogP of 27.73, 2 rotatable bonds, 0 hydrogen bond donors, and 16 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,14,17-tetraene-8,16-dione;(5R)-5,13-dimethylhexacyclo[10.9.0.02,9.05,9.013,18.019,21]henicosa-1(12),2,17-triene-8,16-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene]-8',16'-dione;(5'R)-5',13'-dimethylspiro[cyclopropane-1,19'-pentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene]-8',16'-dione;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,14,17-tetraene-20-carboxylate;methyl (5R,20R)-5,13-dimethyl-8,16-dioxopentacyclo[10.8.0.02,9.05,9.013,18]icosa-1(12),2,17-triene-20-carboxylate is sourced from PubChem (CID 158047944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).