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Chemistry

Mol. Mass

305.42

ALogP

3.79

Rule of 5

Yes

Rule of 3

No
Details
  • SMILES: COc1cc(CNC(=O)CCCC\C=C\C(C)C)ccc1O
  • InChIKey: YKPUWZUDDOIDPM-SOFGYWHQSA-N
    InChI=1S/C18H27NO3/c1-14(2)8-6-4-5-7-9-18(21)19-13-15-10-11-16(20)17(12-15)22-3/h6,8,10-12,14,20H,4-5,7,9,13H2,1-3H3,(H,19,21)/b8-6+
  • Chirality: Single Stereoisomer
  • Inorganic: No
  • Polymer: No

Sources

CHEMBL2108236   ChEMBL
capsicum

CHEMBL294199   ChEMBL
capsaicin

00UK7646FG   NCATS
capsicum *

S07O44R1ZM   NCATS
capsaicin

Capsaicin   Wikipedia

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