Hernandaline

AlkaPlorer ID: AK032283

Synonym: '(+)-Hernandaline'

IUPAC Name: None

Structure

SMILES: COC1=C(OC)C=C(OC2=C(OC)C=C3C(=C2)C[C@H]2C4=C(C=C(OC)C(OC)=C34)CC[NH+]2C)C(C=O)=C1

copy

InChI: InChI=1S/C29H31NO7/c1-30-8-7-16-10-26(35-5)29(36-6)28-19-13-23(33-3)25(11-17(19)9-20(30)27(16)28)37-21-14-24(34-4)22(32-2)12-18(21)15-31/h10-15,20H,7-9H2,1-6H3/p+1/t20-/m0/s1

copy

InChIKey: HLUNBGMOGGEWFX-FQEVSTJZSA-O

copy

Source

Species Genus Family Order Class Phylum Kingdom Domain
Hernandia sonora Hernandia Hernandiaceae Laurales Magnoliopsida Streptophyta Viridiplantae Eukaryota

Properties Information

Molecule Weight: 506.57500000000033

TPSA: 76.89000000000001

MolLogP: 3.669400000000001

Number of H-Donors: 1

Number of H-Acceptors: 7

RingCount: 5

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information