cephalonic acid (Q27253602)

Cephalonic acid (English)

14 October 2016

chemical formula

C₂₅H₃₆O₄

1 reference

Cephalonic acid (English)

14 October 2016

canonical SMILES

CC1=CC(=O)C2=C(C(CC3C(CCC3(CC12)C)C(C)CCC=C(C)C)O)C(=O)O

1 reference

Cephalonic acid (English)

14 October 2016

isomeric SMILES

CC1=CC(=O)/C/2=C(/C(C[C@H]3[C@H](CC[C@@]3(C[C@H]12)C)[C@@H](C)CCC=C(C)C)O)\C(=O)O

1 reference

Cephalonic acid (English)

InChI=1S/C25H36O4/c1-14(2)7-6-8-15(3)17-9-10-25(5)13-18-16(4)11-20(26)22(18)23(24(28)29)21(27)12-19(17)25/h7,11,15,17-19,21,27H,6,8-10,12-13H2,1-5H3,(H,28,29)/b23-22-/t15-,17+,18+,19-,21?,25+/m0/s1

14 October 2016

Identifiers

InChI

1 reference

Cephalonic acid (English)

YNWCHERLWLNYDO-ZWQYIRPLSA-N

14 October 2016

InChIKey

1 reference

Global Substance Registration System

Cephalonic acid (English)

14 October 2016

1 reference

UNII

224FTK48U6

cephalonic acid (English)

14 October 2016

1 reference

Ophibolin D (English)

14 October 2016

2 references

Cephalonic acid (English)

matched by identifier from

14 October 2016

InChIKey

YNWCHERLWLNYDO-ZWQYIRPLSA-N

1 reference

2 references

Global Substance Registration System

UNII

224FTK48U6

cephalonic acid (English)