CID 10178370

C23H32O5 — CID 10178370

IUPAC—
SMILESC[C@]12CCC3(CC1=CC(=O)[C@@H]1C2CC[C@@]2(C)[C@H]1CCC21OCCO1)OCCO3
InChIInChI=1S/C23H32O5/c1-20-7-8-22(25-9-10-26-22)14-15(20)13-18(24)19-16(20)3-5-21(2)17(19)4-6-23(21)27-11-12-28-23/h13,16-17,19H,3-12,14H2,1-2H3/t16?,17-,19+,20-,21-/m0/s1
InChIKeyZCKVJCRUBHRHDF-BSMURHKCSA-N
MW388.50 g/mol
LogP3.61
Rot. Bonds

About CID 10178370

CID 10178370 (PubChem CID 10178370) has the molecular formula C23H32O5 and a molecular weight of 388.50 g/mol.

Molecular Properties

Compound NameCID 10178370
PubChem CID10178370
Molecular FormulaC23H32O5
Molecular Weight388.50 g/mol
Exact Mass388.22
IUPAC Name—
SMILESC[C@]12CCC3(CC1=CC(=O)[C@@H]1C2CC[C@@]2(C)[C@H]1CCC21OCCO1)OCCO3
InChIInChI=1S/C23H32O5/c1-20-7-8-22(25-9-10-26-22)14-15(20)13-18(24)19-16(20)3-5-21(2)17(19)4-6-23(21)27-11-12-28-23/h13,16-17,19H,3-12,14H2,1-2H3/t16?,17-,19+,20-,21-/m0/s1
InChIKeyZCKVJCRUBHRHDF-BSMURHKCSA-N
XLogP3.61
TPSA53.99 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.50
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(8'R,9'S,10'R,13'S,14'S)-3',10',13'-trimethylspiro[1,3-dioxolane-2,17'-2,3,4,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene]-7'-one
CID 122680946
actinium;(10R,13S)-10,13-dimethylspiro[1,2,3,4,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene-17,2'-1,3-dioxolane]-3-ol;(10'R,13'S)-3'-hydroxy-10',13'-dimethylspiro[1,3-dioxolane-2,17'-2,3,4,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene]-7'-one
CID 157490658
CID 125035711
CID 125035711
CID 11872269
CID 11872269
CID 40544151
CID 40544151
CID 13370497
CID 13370497
(3S,8R,9S,10R,13S,14S,17R)-17-ethynyl-3,17-dihydroxy-10,13-dimethyl-2,3,4,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthren-7-one
CID 87650456
(8'S,9'S,10'R,13'R,14'S)-10',13'-dimethylspiro[1,3-dioxolane-2,3'-2,4,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene]-17'-one
CID 11890892
(10'S,13'S)-10',13'-dimethylspiro[1,3-dioxolane-2,3'-2,4,7,8,9,11,12,14,15,16-decahydro-1H-cyclopenta[a]phenanthrene]-17'-one
CID 23828116
CID 85434738
CID 85434738
CID 22799609
CID 22799609
CID 90841414
CID 90841414

Frequently Asked Questions

What is the IUPAC name of CID 10178370?
The IUPAC name of CID 10178370 (CID 10178370) is not available.
What is the SMILES notation for CID 10178370?
The canonical SMILES for CID 10178370 is C[C@]12CCC3(CC1=CC(=O)[C@@H]1C2CC[C@@]2(C)[C@H]1CCC21OCCO1)OCCO3.
What is the InChIKey of CID 10178370?
The InChIKey is ZCKVJCRUBHRHDF-BSMURHKCSA-N. The full InChI is InChI=1S/C23H32O5/c1-20-7-8-22(25-9-10-26-22)14-15(20)13-18(24)19-16(20)3-5-21(2)17(19)4-6-23(21)27-11-12-28-23/h13,16-17,19H,3-12,14H2,1-2H3/t16?,17-,19+,20-,21-/m0/s1.
What are the key properties of CID 10178370?
CID 10178370 has a molecular weight of 388.50 g/mol, XLogP of 3.61, 0 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for CID 10178370 is sourced from PubChem (CID 10178370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).