15-Acetylsongoramine

AlkaPlorer ID: AK574788

Synonym: None

IUPAC Name: None

Structure

SMILES: C=C1[C@@H]2[C@H](O)[C@@H]3[C@H]4N5C[C@@]6(C)CC(=O)C[C@]47C([C@H]2OC(=O)C2=CC=CC=C2)[C@]3(C[C@H]5[C@H]67)[C@@H]1OC(C)=O

copy

InChI: InChI=1S/C29H31NO6/c1-13-18-20(33)19-24-29-10-16(32)9-27(3)12-30(24)17(22(27)29)11-28(19,25(13)35-14(2)31)23(29)21(18)36-26(34)15-7-5-4-6-8-15/h4-8,17-25,33H,1,9-12H2,2-3H3/t17-,18+,19+,20-,21-,22+,23?,24+,25+,27+,28+,29-/m0/s1

copy

InChIKey: XUKQBWKRCZANJN-MHCWCLSWSA-N

copy

Source

Properties Information

Molecule Weight: 489.56800000000027

TPSA: 93.14

MolLogP: 2.3785000000000007

Number of H-Donors: 1

Number of H-Acceptors: 7

RingCount: 10

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information