act-001 Report issue

Small molecule Experimental

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Chemistry

Mol. Mass

293.4012

ALogP

1.98

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: CN(C)C[C@H]1[C@@H]2CCC(C)=C3CC[C@@](C)(O)[C@@H]3[C@H]2OC1=O
  • InChIKey: ZPBIJIIQXPRJSS-WNZSCWOMSA-N
    1S/C17H27NO3/c1-10-5-6-12-13(9-18(3)4)16(19)21-15(12)14-11(10)7-8-17(14,2)20/h12-15,20H,5-9H2,1-4H3/t12-,13-,14-,15-,17+/m0/s1
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL2220079   ChEMBL
act-001

580BNQ45EO   NCATS
act-001 *

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