U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C34H47NO2
Molecular Weight 501.7425
Optical Activity UNSPECIFIED
Defined Stereocenters 7 / 7
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of ORIC-101

SMILES

[H][C@@]12CC[C@@](O)(C#CC(C)(C)C)[C@@]1(C)C[C@H](C3=CC=C(C=C3)N(C)C(C)C)[C@]4([H])[C@@]5([H])CCC(=O)C=C5CC[C@@]24[H]

InChI

InChIKey=VNLTWJIWEYPBIF-KMSLUKAPSA-N
InChI=1S/C34H47NO2/c1-22(2)35(7)25-11-8-23(9-12-25)29-21-33(6)30(16-17-34(33,37)19-18-32(3,4)5)28-14-10-24-20-26(36)13-15-27(24)31(28)29/h8-9,11-12,20,22,27-31,37H,10,13-17,21H2,1-7H3/t27-,28-,29+,30-,31+,33-,34+/m0/s1

HIDE SMILES / InChI

Molecular Formula C34H47NO2
Molecular Weight 501.7425
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 6 / 7
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Thu Jul 06 19:27:13 UTC 2023
Edited
by admin
on Thu Jul 06 19:27:13 UTC 2023
Record UNII
VI6E2D3CYP
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
ORIC-101
Code English
19,21-DINORCHOL-4-EN-20(22)-YN-3-ONE, 17-HYDROXY-23,23-DIMETHYL-11-(4-(METHYL(1-METHYLETHYL)AMINO)PHENYL)-, (11.BETA.,17.ALPHA.)-
Systematic Name English
ORIC101
Code English
ORIC 101 [WHO-DD]
Common Name English
Code System Code Type Description
CAS
2222344-98-9
Created by admin on Thu Jul 06 19:27:13 UTC 2023 , Edited by admin on Thu Jul 06 19:27:13 UTC 2023
PRIMARY
FDA UNII
VI6E2D3CYP
Created by admin on Thu Jul 06 19:27:13 UTC 2023 , Edited by admin on Thu Jul 06 19:27:13 UTC 2023
PRIMARY
NCI_THESAURUS
C162509
Created by admin on Thu Jul 06 19:27:13 UTC 2023 , Edited by admin on Thu Jul 06 19:27:13 UTC 2023
PRIMARY
PUBCHEM
134415769
Created by admin on Thu Jul 06 19:27:13 UTC 2023 , Edited by admin on Thu Jul 06 19:27:13 UTC 2023
PRIMARY
SMS_ID
300000042459
Created by admin on Thu Jul 06 19:27:13 UTC 2023 , Edited by admin on Thu Jul 06 19:27:13 UTC 2023
PRIMARY
Related Record Type Details
TARGET -> INHIBITOR
Related Record Type Details
ACTIVE MOIETY