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Details

Stereochemistry ABSOLUTE
Molecular Formula C15H26O
Molecular Weight 222.3663
Optical Activity UNSPECIFIED
Defined Stereocenters 1 / 1
E/Z Centers 1
Charge 0

SHOW SMILES / InChI
Structure of NEROLIDOL, (6E)-(-)-

SMILES

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

InChI

InChIKey=FQTLCLSUCSAZDY-GOFCXVBSSA-N
InChI=1S/C15H26O/c1-6-15(5,16)12-8-11-14(4)10-7-9-13(2)3/h6,9,11,16H,1,7-8,10,12H2,2-5H3/b14-11+/t15-/m0/s1

HIDE SMILES / InChI

Molecular Formula C15H26O
Molecular Weight 222.3663
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 1 / 1
E/Z Centers 1
Optical Activity UNSPECIFIED

Approval Year

PubMed

PubMed

TitleDatePubMed
Structure-activity relationships for a large diverse set of natural, synthetic, and environmental estrogens.
2001 Mar
The maize gene terpene synthase 1 encodes a sesquiterpene synthase catalyzing the formation of (E)-beta-farnesene, (E)-nerolidol, and (E,E)-farnesol after herbivore damage.
2002 Dec
Prediction of estrogen receptor agonists and characterization of associated molecular descriptors by statistical learning methods.
2006 Nov
Substance Class Chemical
Created
by admin
on Fri Dec 15 19:55:05 GMT 2023
Edited
by admin
on Fri Dec 15 19:55:05 GMT 2023
Record UNII
UOC0644V25
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
NEROLIDOL, (6E)-(-)-
Common Name English
1,6,10-DODECATRIEN-3-OL, 3,7,11-TRIMETHYL-, (3R,6E)-
Systematic Name English
Code System Code Type Description
FDA UNII
UOC0644V25
Created by admin on Fri Dec 15 19:55:05 GMT 2023 , Edited by admin on Fri Dec 15 19:55:05 GMT 2023
PRIMARY
CAS
77551-75-8
Created by admin on Fri Dec 15 19:55:05 GMT 2023 , Edited by admin on Fri Dec 15 19:55:05 GMT 2023
PRIMARY
PUBCHEM
11241545
Created by admin on Fri Dec 15 19:55:05 GMT 2023 , Edited by admin on Fri Dec 15 19:55:05 GMT 2023
PRIMARY