ajacisine H

AlkaPlorer ID: AK016107

Synonym: None

IUPAC Name: None

Structure

SMILES: C[C@@]1(C([N@@]2[C@H]3[C@H]4C5OC(C6=CC=CC=C6)=O)O)CC(OC(C)=O)C[C@]73[C@]1([H])[C@H]2C[C@]4(C8)[C@@]7([H])[C@H](O)[C@H]5C8=C

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InChI: InChI=1S/C29H33NO6/c1-13-9-28-12-17-22-27(3)10-16(35-14(2)31)11-29(22)23(28)20(32)18(13)21(19(28)24(29)30(17)26(27)34)36-25(33)15-7-5-4-6-8-15/h4-8,16-24,26,32,34H,1,9-12H2,2-3H3/t16?,17-,18-,19-,20-,21?,22-,23-,24+,26?,27-,28+,29+/m1/s1

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InChIKey: FJIZXKWXBROPOB-UFUHNJKFSA-N

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Source

Properties Information

Molecule Weight: 491.58400000000034

TPSA: 96.3

MolLogP: 2.517900000000001

Number of H-Donors: 2

Number of H-Acceptors: 7

RingCount: 10

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information