17-hydroxylupanine(1+) (Q27133170)

17-hydroxylupanine (English)

7 October 2016

chemical formula

C₁₅H₂₅N₂O₂⁺

1 reference

based on heuristic

inferred from SMILES

canonical SMILES

C1CC[NH+]2C(C1)C3CC(C2O)C4CCCC(=O)N4C3

1 reference

17-hydroxylupanine (English)

7 October 2016

isomeric SMILES

C1CC[NH+]2[C@@H](C1)[C@H]3C[C@@H](C2O)[C@H]4CCCC(=O)N4C3

1 reference

17-hydroxylupanine (English)

InChI=1S/C15H24N2O2/c18-14-6-3-5-13-11-8-10(9-17(13)14)12-4-1-2-7-16(12)15(11)19/h10-13,15,19H,1-9H2/p+1/t10-,11+,12-,13+,15?/m0/s1

7 October 2016

Identifiers

InChI

1 reference

17-hydroxylupanine (English)

LCORZQTZVFOPGT-IZADBBIGSA-O

7 October 2016

InChIKey

2 references

17-hydroxylupanine (English)

7 October 2016

stated in

ChEBI release 2020-09-01

1 reference

17-hydroxylupanine(1+) (English)

7 October 2016

2 references

17-hydroxylupanine (English)

matched by identifier from

7 October 2016

InChIKey

LCORZQTZVFOPGT-IZADBBIGSA-O

ChEBI ID

64262

mapping relation type

2 references

17-hydroxylupanine(1+) (English)