Showing RIpred-Card for (3Z)-phytochromobilin,1TBDMS,isomer#1 (RI01703731)

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IdentificationPhysical propertiesReferencesXML
Record Information
Version1.0
Created at2023-04-11 00:00:00 UTC
Updated at2023-04-11 00:00:00 UTC
RI-Pred IDRI01703731
Compound Identification
Common Name(3Z)-phytochromobilin,1TBDMS,isomer#1
Structure
Average Molecular Weight696.3354
SMILESC=CC1=C(C)C(=CC2=NC(=CC3=C(CCC(=O)[O-])C(C)=C(C=C4C(=CC)C(C)C(=O)N4[Si](C)(C)C(C)(C)C)[NH]3)C(CCC(=O)[O-])=C2C)NC1=O
Physical Properties
Predicted Properties
PropertyValueReference
Retention Index5161.6704
References
General ReferencesAccurate Prediction of Gas Chromatographic Kováts Retention Indices