CID 143827916

C25H32O3 — CID 143827916

IUPAC—
SMILESCC[C@]12CCC3C4CCC(=O)C=C4C4(CC4)CC3C1C1CC1C21CCC(=O)O1
InChIInChI=1S/C25H32O3/c1-2-24-7-5-15-16-4-3-14(26)11-19(16)23(9-10-23)13-18(15)22(24)17-12-20(17)25(24)8-6-21(27)28-25/h11,15-18,20,22H,2-10,12-13H2,1H3/t15?,16?,17?,18?,20?,22?,24-,25?/m0/s1
InChIKeyLGYYZZCPRJHGTP-JWHFLMKOSA-N
MW380.53 g/mol
LogP4.84
Rot. Bonds1

About CID 143827916

CID 143827916 (PubChem CID 143827916) has the molecular formula C25H32O3 and a molecular weight of 380.53 g/mol.

Molecular Properties

Compound NameCID 143827916
PubChem CID143827916
Molecular FormulaC25H32O3
Molecular Weight380.53 g/mol
Exact Mass380.24
IUPAC Name—
SMILESCC[C@]12CCC3C4CCC(=O)C=C4C4(CC4)CC3C1C1CC1C21CCC(=O)O1
InChIInChI=1S/C25H32O3/c1-2-24-7-5-15-16-4-3-14(26)11-19(16)23(9-10-23)13-18(15)22(24)17-12-20(17)25(24)8-6-21(27)28-25/h11,15-18,20,22H,2-10,12-13H2,1H3/t15?,16?,17?,18?,20?,22?,24-,25?/m0/s1
InChIKeyLGYYZZCPRJHGTP-JWHFLMKOSA-N
XLogP4.84
TPSA43.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.53
LogP ≤ 54.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(5S,7'S,11'R)-18'-ethenyl-7'-ethylspiro[oxolane-5,6'-pentacyclo[8.8.0.02,7.03,5.011,16]octadec-15-ene]-2,14'-dione
CID 59612687
(5S,7'S,11'R)-7'-ethyl-17'-hydroxy-14'-iminospiro[oxolane-5,6'-pentacyclo[8.8.0.02,7.03,5.011,16]octadec-15-ene]-2-one
CID 89005699
CID 159089239
CID 159089239
(1R,2R,3R,5S,6S,7S,10S,11R)-7-ethyl-6-methyl-14-oxopentacyclo[8.8.0.02,7.03,5.011,16]octadec-15-ene-6-carbonitrile
CID 46234435
(5S,7'S,17'R)-17'-(hydroxymethyl)-7'-methylspiro[oxolane-5,6'-pentacyclo[8.8.0.02,7.03,5.011,16]octadec-15-ene]-2,14'-dione
CID 59612698
(14S,15S)-14-ethylspiro[hexacyclo[9.8.0.02,4.05,10.014,19.016,18]nonadec-5(10)-ene-15,5'-oxolane]-2',7-dione
CID 90853311
(5S,7'S)-14'-amino-18'-cyclopropyl-7'-ethylspiro[oxolane-5,6'-pentacyclo[8.8.0.02,7.03,5.011,16]octadeca-11(16),14-diene]-2-one
CID 91144962
13-methyl-3-oxospiro[1,2,7,8,9,10,11,12,14,15,16,17-dodecahydrocyclopenta[a]phenanthrene-6,1'-cyclopropane]-17-carbonitrile
CID 90714263
(5S,7'S,18'S)-18'-cyclopropyl-7'-methylspiro[oxolane-5,6'-pentacyclo[8.8.0.02,7.03,5.011,16]octadec-15-ene]-2,14'-dione
CID 59612712
(1R,4R,10R,11S,14S,15S,16S,18S,19S)-10,14-dimethylspiro[hexacyclo[9.8.0.02,4.05,10.014,19.016,18]nonadec-5-ene-15,5'-oxolane]-2',7-dione
CID 143842889
(1R,10R,11S,14S,15S,16S,18S,19S)-10,14-dimethylspiro[hexacyclo[9.8.0.02,4.05,10.014,19.016,18]nonadec-5-ene-15,5'-oxolane]-2',7-dione
CID 59779299
(10R,14S,15S,16S)-10,14-dimethylspiro[hexacyclo[9.8.0.02,4.05,10.014,19.016,18]nonadec-5-ene-15,5'-oxolane]-2',7-dione
CID 143801851

Frequently Asked Questions

What is the IUPAC name of CID 143827916?
The IUPAC name of CID 143827916 (CID 143827916) is not available.
What is the SMILES notation for CID 143827916?
The canonical SMILES for CID 143827916 is CC[C@]12CCC3C4CCC(=O)C=C4C4(CC4)CC3C1C1CC1C21CCC(=O)O1.
What is the InChIKey of CID 143827916?
The InChIKey is LGYYZZCPRJHGTP-JWHFLMKOSA-N. The full InChI is InChI=1S/C25H32O3/c1-2-24-7-5-15-16-4-3-14(26)11-19(16)23(9-10-23)13-18(15)22(24)17-12-20(17)25(24)8-6-21(27)28-25/h11,15-18,20,22H,2-10,12-13H2,1H3/t15?,16?,17?,18?,20?,22?,24-,25?/m0/s1.
What are the key properties of CID 143827916?
CID 143827916 has a molecular weight of 380.53 g/mol, XLogP of 4.84, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for CID 143827916 is sourced from PubChem (CID 143827916), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).