3H-Pyrido[3,4-b]indol-7-ol, 4,9-dihydro-1-methyl-, hydrate (1:3)
CAS Registry Number®
6027-99-2
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CAS Name
3H-Pyrido[3,4-b]indol-7-ol, 4,9-dihydro-1-methyl-, hydrate (1:3)Molecular Formula
C12H12N2O.3H2OCite this Page
3H-Pyrido[3,4-b]indol-7-ol, 4,9-dihydro-1-methyl-, hydrate (1:3). CAS Common Chemistry. CAS, a division of the American Chemical Society, n.d. http://commonchemistry.cas.org/detail?cas_rn=6027-99-2 (retrieved ) (CAS RN: 6027-99-2). Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).Other Names and Identifiers
InChI
InChI=1S/C12H12N2O.3H2O/c1-7-12-10(4-5-13-7)9-3-2-8(15)6-11(9)14-12;;;/h2-3,6,14-15H,4-5H2,1H3;3*1H2
InChIKey
InChIKey=PMKVQXPQTXKYGD-UHFFFAOYSA-N
SMILES
CC=1C2=C(C=3C(N2)=CC(O)=CC3)CCN1.O
Canonical SMILES
O.OC=1C=CC2=C(C1)NC=3C(=NCCC23)C
Other Names for this Substance
- 3H-Pyrido[3,4-b]indol-7-ol, 4,9-dihydro-1-methyl-, hydrate (1:3)
- 3H-Pyrido[3,4-b]indol-7-ol, 4,9-dihydro-1-methyl-, trihydrate
- Harmalol, trihydrate
