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Euojaponine I

AlkaPlorer ID: AK065406

Synonym: ''

IUPAC Name: [(1S,3R,13R,14S,17R,18R,19S,20S,21R,22R,23R,24R,25S)-18,21,22,24-tetraacetyloxy-20-(acetyloxymethyl)-25-hydroxy-3,13,14,25-tetramethyl-6,15-dioxo-2,5,16-trioxa-11-azapentacyclo[15.7.1.01,20.03,23.07,12]pentacosa-7(12),8,10-trien-19-yl] pyridine-3-carboxylate

Structure

SMILES: CC(=O)OC[C@]12[C@H](OC(=O)C3=CC=CN=C3)[C@@H](OC(C)=O)[C@H]3OC(=O)[C@@H](C)[C@@H](C)C4=NC=CC=C4C(=O)OC[C@]4(C)O[C@@]1([C@H](OC(C)=O)[C@H]4[C@@H](OC(C)=O)[C@@H]2OC(C)=O)[C@@]3(C)O

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InChI: InChI=1S/C42H48N2O18/c1-19-20(2)36(50)60-33-31(57-23(5)47)35(61-37(51)26-12-10-14-43-16-26)41(18-54-21(3)45)34(59-25(7)49)30(56-22(4)46)28-32(58-24(6)48)42(41,40(33,9)53)62-39(28,8)17-55-38(52)27-13-11-15-44-29(19)27/h10-16,19-20,28,30-35,53H,17-18H2,1-9H3/t19-,20+,28-,30-,31+,32-,33-,34+,35-,39+,40+,41+,42+/m1/s1

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InChIKey: ICJMGMIQWBNSNM-XCMADQDISA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain

Properties Information

Molecule Weight: 868.8420000000001

TPSA？: 265.64

MolLogP？: 1.7224000000000024

Number of H-Donors: 1

Number of H-Acceptors: 20

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information