a-51493a (Q27251704)

UNII-1581OQB318 (English)

14 October 2016

chemical formula

C₃₀H₃₁NO₁₀

1 reference

UNII-1581OQB318 (English)

14 October 2016

canonical SMILES

CC1C(C(CC(O1)OC(CO)(C2CO2)C3=CC(=O)C4=C(C=C5C(=C4O3)C(=O)C6=C(C5=O)C=CC=C6O)C)N(C)C)O

1 reference

UNII-1581OQB318 (English)

14 October 2016

isomeric SMILES

CC1[C@H]([C@H](C[C@@H](O1)OC(CO)(C2CO2)C3=CC(=O)C4=C(C=C5C(=C4O3)C(=O)C6=C(C5=O)C=CC=C6O)C)N(C)C)O

1 reference

UNII-1581OQB318 (English)

InChI=1S/C30H31NO10/c1-13-8-16-25(28(37)24-15(27(16)36)6-5-7-18(24)33)29-23(13)19(34)10-20(40-29)30(12-32,21-11-38-21)41-22-9-17(31(3)4)26(35)14(2)39-22/h5-8,10,14,17,21-22,26,32-33,35H,9,11-12H2,1-4H3/t14?,17-,21?,22-,26+,30?/m0/s1

14 October 2016

Identifiers

InChI

1 reference

UNII-1581OQB318 (English)

DPEJSNRXRQGSSD-YBJSLIEJSA-N

14 October 2016

InChIKey

1 reference

Global Substance Registration System

UNII-1581OQB318 (English)

14 October 2016

1 reference

UNII

1581OQB318

a-51493a (English)

14 October 2016

2 references

UNII-1581OQB318 (English)

matched by identifier from

14 October 2016

InChIKey

DPEJSNRXRQGSSD-YBJSLIEJSA-N

1 reference

0 references

DSSTOX compound identifier

0 references

2 references

Global Substance Registration System

UNII

1581OQB318

a-51493a (English)