(Q27256526)

inferred from isomeric SMILES

stereoisomer of

[(1S,2S,6S,9S,10S,11R,12R,13S,14S,15S,16R,18S,19S,22S,23S,25R)-10,12,13,14,16,23-hexahydroxy-6,10,19-trimethyl-24-oxa-4-azaheptacyclo[12.12.0.02,11.04,9.015,25.018,23.019,25]hexacosan-22-yl] (2R)-2-methylbutanoate

2 references

inferred from InChIKey

inferred from InChI

chemical formula

C₃₂H₅₁NO₉

1 reference

inferred from SMILES

canonical SMILES

CCC(C)C(=O)OC1CCC2(C3C1(OC24CC5C6CN7CC(CCC7C(C6C(C(C5(C4C(C3)O)O)O)O)(C)O)C)O)C

1 reference

protoveratridine (English)

14 October 2016

isomeric SMILES

CC[C@@H](C)C(=O)O[C@H]1CC[C@]2([C@H]3[C@]1(O[C@@]24C[C@H]5[C@@H]6CN7C[C@H](CC[C@H]7[C@@]([C@H]6[C@H]([C@@H]([C@]5([C@@H]4[C@@H](C3)O)O)O)O)(C)O)C)O)C

1 reference

protoveratridine (English)

InChI=1S/C32H51NO9/c1-6-16(3)27(37)41-22-9-10-28(4)20-11-19(34)25-30(28,42-32(20,22)40)12-18-17-14-33-13-15(2)7-8-21(33)29(5,38)23(17)24(35)26(36)31(18,25)39/h15-26,34-36,38-40H,6-14H2,1-5H3/t15-,16+,17-,18-,19+,20-,21-,22-,23+,24+,25+,26-,28-,29+,30+,31-,32+/m0/s1

14 October 2016

Identifiers

InChI

1 reference

protoveratridine (English)

SGTJIQOCQLGWBX-FXWKDPFOSA-N

14 October 2016

InChIKey

1 reference

protoveratridine (English)

14 October 2016

1 reference

matched by identifier from

protoveratridine (English)

14 October 2016

2 references

26 December 2021

InChIKey

SGTJIQOCQLGWBX-FXWKDPFOSA-N

1 reference

reason for deprecated rank

cannot be confirmed by other sources

1 reference

protoveratridine (English)