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Details

Stereochemistry ABSOLUTE
Molecular Formula C33H49NO8
Molecular Weight 587.7441
Optical Activity UNSPECIFIED
Defined Stereocenters 15 / 15
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of PSEUDOJERVINE

SMILES

C[C@@H]1[C@@H]2NC[C@@H](C)C[C@H]2O[C@]13CC[C@H]4[C@@H]5CC=C6C[C@H](CC[C@]6(C)[C@H]5C(=O)C4=C3C)O[C@@H]7O[C@H](CO)[C@@H](O)[C@H](O)[C@H]7O

InChI

InChIKey=HYDDDNUKNMMWBD-VPLHBGEQSA-N
InChI=1S/C33H49NO8/c1-15-11-22-26(34-13-15)17(3)33(42-22)10-8-20-21-6-5-18-12-19(40-31-30(39)29(38)27(36)23(14-35)41-31)7-9-32(18,4)25(21)28(37)24(20)16(33)2/h5,15,17,19-23,25-27,29-31,34-36,38-39H,6-14H2,1-4H3/t15-,17+,19-,20-,21-,22+,23+,25+,26-,27+,29-,30+,31+,32-,33-/m0/s1

HIDE SMILES / InChI

Molecular Formula C33H49NO8
Molecular Weight 587.7441
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 15 / 15
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 22:56:33 GMT 2025
Edited
by admin
on Mon Mar 31 22:56:33 GMT 2025
Record UNII
6ZVR3FG6VQ
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
PSEUDOJERVINE [MI]
Preferred Name English
PSEUDOJERVINE
MI  
Common Name English
Code System Code Type Description
PUBCHEM
16398499
Created by admin on Mon Mar 31 22:56:33 GMT 2025 , Edited by admin on Mon Mar 31 22:56:33 GMT 2025
PRIMARY
EPA CompTox
DTXSID60957480
Created by admin on Mon Mar 31 22:56:33 GMT 2025 , Edited by admin on Mon Mar 31 22:56:33 GMT 2025
PRIMARY
CAS
36069-05-3
Created by admin on Mon Mar 31 22:56:33 GMT 2025 , Edited by admin on Mon Mar 31 22:56:33 GMT 2025
PRIMARY
FDA UNII
6ZVR3FG6VQ
Created by admin on Mon Mar 31 22:56:33 GMT 2025 , Edited by admin on Mon Mar 31 22:56:33 GMT 2025
PRIMARY
MERCK INDEX
m441
Created by admin on Mon Mar 31 22:56:33 GMT 2025 , Edited by admin on Mon Mar 31 22:56:33 GMT 2025
PRIMARY Merck Index