Molecule

Rhizoxin D

AlkaPlorer ID: AK088981

Synonym: ''

IUPAC Name: (1R,3E,7S,9S,10E,12E,14R,15R)-9-hydroxy-7-[(2S,3R,4E,6E,8E)-3-methoxy-4,8-dimethyl-9-(2-methyl-1,3-oxazol-4-yl)nona-4,6,8-trien-2-yl]-10,14-dimethyl-6,16-dioxabicyclo[13.3.1]nonadeca-3,10,12-triene-5,17-dione

Structure

SMILES: CO[C@@H](/C(C)=C/C=C/C(C)=C/C1=COC(C)=N1)[C@@H](C)[C@@H]1C[C@H](O)/C(C)=C/C=C/[C@@H](C)[C@H]2C[C@@H](C/C=C/C(=O)O1)CC(=O)O2

InChI: InChI=1S/C35H47NO7/c1-22(17-29-21-41-27(6)36-29)11-8-14-25(4)35(40-7)26(5)32-20-30(37)23(2)12-9-13-24(3)31-18-28(19-34(39)42-31)15-10-16-33(38)43-32/h8-14,16-17,21,24,26,28,30-32,35,37H,15,18-20H2,1-7H3/b11-8+,13-9+,16-10+,22-17+,23-12+,25-14+/t24-,26+,28-,30+,31-,32+,35+/m1/s1

InChIKey: BDCIVUTULLELHY-BRPJXHCYSA-N

Reference

Studies on macrocyclic lactone antibiotics. IX. Novel macrolides from the fungus Rhizopus chinensis: Precursors of rhizoxin.

PubChem CID: 9808665

LOTUS: LTS0135991

Source

Species	Genus	Family	Order	Class	Phylum	Kingdom	Domain
Rhizopus microsporus	Rhizopus	Rhizopodaceae	Mucorales	Mucoromycetes	Mucoromycota	Fungi	Eukaryota

Properties Information

Molecule Weight: 593.7610000000002

TPSA？: 108.09000000000002

MolLogP？: 6.623020000000008

Number of H-Donors: 1

Number of H-Acceptors: 8

RingCount: 3

Activities Information

Organism	Target Name	Standard Type	Standard Value	Standard Units	doi