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1920-Epoxycytochalasin N

AlkaPlorer ID: AK028774

Synonym: '', '19,20-Epoxycytochalasin N'

IUPAC Name: [(1R,2R,3S,5R,6R,8S,10E,12R,13S,14S,16R,17S,18R)-18-benzyl-6,13-dihydroxy-6,8,14,16-tetramethyl-7,20-dioxo-4,15-dioxa-19-azapentacyclo[10.8.0.01,17.03,5.014,16]icos-10-en-2-yl] acetate

Structure

SMILES: CC(=O)O[C@H]1[C@@H]2O[C@H]2[C@@](C)(O)C(=O)[C@@H](C)C/C=C/[C@H]2[C@H](O)[C@]3(C)O[C@]3(C)[C@@H]3[C@@H](CC4=CC=CC=C4)NC(=O)[C@@]321

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InChI: InChI=1S/C30H37NO8/c1-15-10-9-13-18-23(34)29(5)28(4,39-29)21-19(14-17-11-7-6-8-12-17)31-26(35)30(18,21)25(37-16(2)32)20-24(38-20)27(3,36)22(15)33/h6-9,11-13,15,18-21,23-25,34,36H,10,14H2,1-5H3,(H,31,35)/b13-9+/t15-,18-,19+,20+,21-,23-,24+,25-,27-,28+,29-,30+/m0/s1

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InChIKey: RGIWEJOMKQEMPD-NZIPYOAESA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain
Xylaria hypoxylon Xylaria Xylariaceae Xylariales Sordariomycetes Ascomycota Fungi Eukaryota

Properties Information

Molecule Weight: 539.6250000000002

TPSA？: 137.99

MolLogP？: 1.4835999999999994

Number of H-Donors: 3

Number of H-Acceptors: 8

RingCount: 6

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information