PINGBEININE

Details

Stereochemistry	ABSOLUTE
Molecular Formula	C28H47NO3
Molecular Weight	445.6777
Optical Activity	( - )
Defined Stereocenters	11 / 11
E/Z Centers	0
Charge	0

SHOW SMILES / InChI

Structure Search

SMILES

C[C@@H]([C@H]1[C@@H](O)C[C@H]2[C@@H]3CC=C4C[C@@H](O)CC[C@]4(C)[C@H]3CC[C@]12C)[C@H]5CC[C@](C)(O)CN5C

InChI

InChIKey=JTBAWWCDNDKCDH-HXVGSJFWSA-N

InChI=1S/C28H47NO3/c1-17(23-10-11-26(2,32)16-29(23)5)25-24(31)15-22-20-7-6-18-14-19(30)8-12-27(18,3)21(20)9-13-28(22,25)4/h6,17,19-25,30-32H,7-16H2,1-5H3/t17-,19+,20-,21+,22+,23-,24+,25+,26+,27+,28+/m1/s1

HIDE SMILES / InChI

Approval Year

Name

Type

Language

(-)-PINGBEININE

Preferred Name

English

PINGBEININE

Common Name

English

(3S,8S,9S,10R,13S,14S,16S,17R)-17-[(1S)-1-[(2R,5R)-5-hydroxy-1,5-dimethylpiperidin-2-yl]ethyl]-10,13-dimethyl-2,3,4,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthrene-3,16-diol

Systematic Name

English

16,28-SECOSOLANID-5-ENE-3,16,25-TRIOL, 28-METHYL-, (3.BETA.,16.BETA.,25.BETA.)-

Systematic Name

English

(3.BETA.,16.BETA.,20S)-20-((2S,5R)-5-HYDROXY-1,5-DIMETHYL-2-PIPERIDINYL)PREGN-5-ENE-3,16-DIOL

Systematic Name

English

PREGN-5-ENE-3,16-DIOL, 20-((2S,5R)-5-HYDROXY-1,5-DIMETHYL-2-PIPERIDINYL)-, (3.BETA.,16.BETA.,20S)-

Systematic Name

English

Code System Code Type Description

WIKIPEDIA

Pingbeinine