U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS
This repository is under review for potential modification in compliance with Administration directives.

Details

Stereochemistry ABSOLUTE
Molecular Formula C27H43NO8
Molecular Weight 509.6322
Optical Activity UNSPECIFIED
Defined Stereocenters 14 / 14
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of VERACEVINE

SMILES

C[C@H]1CC[C@@H]2N(C1)C[C@H]3[C@]4(O)C[C@@]56O[C@@]7(O)[C@@H](CC[C@H]5[C@]4(O)C[C@H](O)[C@]3(O)[C@]2(C)O)[C@]6(C)CC[C@@H]7O

InChI

InChIKey=MZHXYVMEVBEFAL-XXFAKQOHSA-N
InChI=1S/C27H43NO8/c1-14-4-7-18-22(3,31)26(34)17(12-28(18)11-14)24(33)13-25-16(23(24,32)10-20(26)30)6-5-15-21(25,2)9-8-19(29)27(15,35)36-25/h14-20,29-35H,4-13H2,1-3H3/t14-,15-,16-,17-,18-,19-,20-,21-,22+,23+,24+,25+,26-,27-/m0/s1

HIDE SMILES / InChI

Molecular Formula C27H43NO8
Molecular Weight 509.6322
Charge 0
Count
MOL RATIO 1 MOL RATIO (average)
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 14 / 14
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Record UNII
U3QTV3Z77R
Record Status Validated (UNII)
Record Version