[(2R,4aR,6S,7R,8R,8aR)-6-methoxy-7-oxidanyl-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl] tricosa-10,12-diynoate

Systemtic Name: [(2R,4aR,6S,7R,8R,8aR)-6-methoxy-7-oxidanyl-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl] tricosa-10,12-diynoate Openeye Name: [(2R,4aR,6S,7R,8R,8aR)-7-hydroxy-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl] tricosa-10,12-diynoate CAS Name: tricosa-10,12-diynoic acid [(2R,4aR,6S,7R,8R,8aR)-7-hydroxy-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl] ester IUPAC Name: [(2R,4aR,6S,7R,8R,8aR)-7-hydroxy-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl] tricosa-10,12-diynoate Traditional Name: tricosa-10,12-diynoic acid [(2R,4aR,6S,7R,8R,8aR)-7-hydroxy-6-methoxy-2-phenyl-4,4a,6,7,8,8a-hexahydropyrano[3,2-d][1,3]dioxin-8-yl] ester Formula: C37H54O7 MolecularWeight: 610.82046

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCC#CC#CCCCCCCCCC(=O)OC1C(C(OC2C1OC(OC2)C3=CC=CC=C3)OC)O

Isomeric SMILES

CCCCCCCCCCC#CC#CCCCCCCCCC(=O)O[C@@H]1[C@H]([C@H](O[C@H]2[C@H]1O[C@@H](OC2)C3=CC=CC=C3)OC)O

InChI

InChI=1S/C37H54O7/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-25-28-32(38)43-35-33(39)37(40-2)42-31-29-41-36(44-34(31)35)30-26-23-22-24-27-30/h22-24,26-27,31,33-37,39H,3-11,16-21,25,28-29H2,1-2H3/t31-,33-,34-,35-,36-,37+/m1/s1