U.S. Department of Health & Human Services Divider Arrow National Institutes of Health Divider Arrow NCATS

Details

Stereochemistry ABSOLUTE
Molecular Formula C15H28O7P2
Molecular Weight 382.3261
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of NEROLIDYL PYROPHOSPHATE, (6Z,3S)-

SMILES

CC(C)=CCC\C(C)=C/CC[C@](C)(OP(O)(=O)OP(O)(O)=O)C=C

InChI

InChIKey=SDXCRASCLFBFND-QKXCFHHRSA-N
InChI=1S/C15H28O7P2/c1-6-15(5,21-24(19,20)22-23(16,17)18)12-8-11-14(4)10-7-9-13(2)3/h6,9,11H,1,7-8,10,12H2,2-5H3,(H,19,20)(H2,16,17,18)/b14-11-/t15-/m1/s1

HIDE SMILES / InChI

Molecular Formula C15H28O7P2
Molecular Weight 382.3261
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Sat Dec 16 11:31:06 GMT 2023
Edited
by admin
on Sat Dec 16 11:31:06 GMT 2023
Record UNII
3WI4CO44HA
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NEROLIDYL PYROPHOSPHATE, (6Z,3S)-
Common Name English
DIPHOSPHORIC ACID, P-(1S,4Z)-1-ETHENYL-1,5,9-TRIMETHYL-4,8-DECADIEN-1-YL ESTER
Systematic Name English
NEROLIDYL DIPHOSPHATE, , (6E)-(3S)-
Common Name English
Code System Code Type Description
FDA UNII
3WI4CO44HA
Created by admin on Sat Dec 16 11:31:06 GMT 2023 , Edited by admin on Sat Dec 16 11:31:06 GMT 2023
PRIMARY
PUBCHEM
119025813
Created by admin on Sat Dec 16 11:31:06 GMT 2023 , Edited by admin on Sat Dec 16 11:31:06 GMT 2023
PRIMARY
CAS
132201-50-4
Created by admin on Sat Dec 16 11:31:06 GMT 2023 , Edited by admin on Sat Dec 16 11:31:06 GMT 2023
PRIMARY