1-[(1R,4aS,10aR)-1,4a-dimethyl-7-(propan-2-yl)-1,2,3,4,4a,9,10,10a-octahydrophenanthren-1-yl]methanamine

AlkaPlorer ID: AK003168

Synonym: None

IUPAC Name: [(1R,4aS)-1,4a-dimethyl-7-propan-2-yl-2,3,4,9,10,10a-hexahydrophenanthren-1-yl]methanamine

Structure

SMILES: CC(C)C1=CC=C2C(=C1)CCC1[C@](C)(CN)CCC[C@]21C

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InChI: InChI=1S/C20H31N/c1-14(2)15-6-8-17-16(12-15)7-9-18-19(3,13-21)10-5-11-20(17,18)4/h6,8,12,14,18H,5,7,9-11,13,21H2,1-4H3/t18?,19-,20+/m0/s1

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InChIKey: JVVXZOOGOGPDRZ-NRRUETGQSA-N

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Reference

PubChem CID: 118215

NPASS: NPC82550

Source

Species Genus Family Order Class Phylum Kingdom Domain
Carthamus tinctorius Carthamus Asteraceae Asterales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 285.475

TPSA: 26.02

MolLogP: 4.779000000000004

Number of H-Donors: 1

Number of H-Acceptors: 1

RingCount: 3

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information