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Details

Stereochemistry ABSOLUTE
Molecular Formula C27H44O3
Molecular Weight 416.6365
Optical Activity UNSPECIFIED
Defined Stereocenters 5 / 6
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of DP-001

SMILES

[H][C@@]12CCC([C@@H](C)CCCC(C)(C)O)[C@@]1(C)CCC\C2=C/C=C3C[C@@H](O)C(=C)[C@H](O)C3

InChI

InChIKey=UHMPCVGLSKFXHR-NFZXMVPNSA-N
InChI=1S/C27H44O3/c1-18(8-6-14-26(3,4)30)22-12-13-23-21(9-7-15-27(22,23)5)11-10-20-16-24(28)19(2)25(29)17-20/h10-11,18,22-25,28-30H,2,6-9,12-17H2,1,3-5H3/b21-11+/t18-,22?,23-,24+,25+,27+/m0/s1

HIDE SMILES / InChI

Molecular Formula C27H44O3
Molecular Weight 416.6365
Charge 0
Count
Stereochemistry EPIMERIC
Additional Stereochemistry No
Defined Stereocenters 5 / 6
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 04:57:56 GMT 2023
Edited
by admin
on Sat Dec 16 04:57:56 GMT 2023
Record UNII
O9W659OF5L
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
DP-001
Common Name English
1,3-CYCLOHEXANEDIOL, 2-METHYLENE-5-((2E)-2-((1R,3AS,7AR)-OCTAHYDRO-1-((1S)-5-HYDROXY-1,5-DIMETHYLHEXYL)-7A-METHYL-4H-INDEN-4-YLIDENE)ETHYLIDENE)-, (1R,3R)-
Systematic Name English
2-METHYLENE-19-NOR-20-EPI-1A,25-DIHYDROXYVITAMIN D3
Common Name English
2MD
Code English
2-METHYLENE-19-NOR-(20S)-1.ALPHA.,25-DIHYDROXYVITAMIN D3
Common Name English
Code System Code Type Description
PUBCHEM
11366080
Created by admin on Sat Dec 16 04:57:56 GMT 2023 , Edited by admin on Sat Dec 16 04:57:56 GMT 2023
PRIMARY
ChEMBL
CHEMBL605525
Created by admin on Sat Dec 16 04:57:56 GMT 2023 , Edited by admin on Sat Dec 16 04:57:56 GMT 2023
PRIMARY
FDA UNII
O9W659OF5L
Created by admin on Sat Dec 16 04:57:56 GMT 2023 , Edited by admin on Sat Dec 16 04:57:56 GMT 2023
PRIMARY
CAS
213250-70-5
Created by admin on Sat Dec 16 04:57:56 GMT 2023 , Edited by admin on Sat Dec 16 04:57:56 GMT 2023
PRIMARY
Related Record Type Details
ACTIVE MOIETY