PubChem CID | 443156 |
Molecular Formula | C10H16 |
Structure |
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Synonyms |
(+)-3-Carene
498-15-7 (1S,6R)-3,7,7-trimethylbicyclo[4.1.0]hept-3-ene Isodiprene (1S)-(+)-3-Carene (+)-delta3-Carene (+)-car-3-ene (+)-D-3-Carene 3-Carene, (+)- (+)-Delta(3)-carene (1S)-3,7,7-trimethylbicyclo[4.1.0]hept-3-ene XBL40A7IA6 1352058-87-7 Bicyclo[4.1.0]hept-3-ene, 3,7,7-trimethyl-, (1S,6R)- (S)-(+)-3-Carene 3-Carene, (1S,6R)-(+)- (1S)-3,7,7-Trimethylbicyclo(4.1.0)hept-3-ene Bicyclo(4.1.0)hept-3-ene, 3,7,7-trimethyl-, (1S,6R)- (+)-alpha-carene .delta. 3-carene 3-.delta.-Carene .DELTA.-caR-3-ene (+)-.delta.3-Carene 4,7,7-Trimethyl-3-norcarene (1S,6R)-3-Carene UNII-XBL40A7IA6 (1S,6R)-(+)-3-carene Bicyclo(4.1.0)hept-3-ene, 3,7,7-trimethyl-, (1S)- 3,7,7-trimethyl bicyclohept-3-ene MFCD00066417 EINECS 207-856-6 .delta.-3-Carene Bicyclo[4.1.0]hept-3-ene, 3,7,7-trimethyl- CHEBI:7 1alpha,6alpha-car-3-ene (+)-3-Carene 1000 microg/mL in Isopropanol (1R,6S)-4,7,7-trimethylbicyclo[4.1.0]hept-3-ene DTXSID60858827 (+)-3-Carene, analytical standard AKOS024462648 (1S)-(+)-3-Carene, 99% LMPR0102120021 AS-67519 HY-126027 CS-0090277 NS00116192 D78494 EN300-198858 A827862 J-511415 Q15222640 (+)-3-delta-Carene, primary pharmaceutical reference standard |
IUPAC Name | (1S,6R)-3,7,7-trimethylbicyclo[4.1.0]hept-3-ene |
SMILES | CC1=CC[C@@H]2[C@H](C1)C2(C)C |
Canonical SMILES | CC1=CCC2C(C1)C2(C)C |
InChI | InChI=1S/C10H16/c1-7-4-5-8-9(6-7)10(8,2)3/h4,8-9H,5-6H2,1-3H3/t8-,9+/m1/s1 |
InChIKey | BQOFWKZOCNGFEC-BDAKNGLRSA-N |
Molecular Weight | 136.23 g/mol |
XLogP3 | 2.8 |
Hydrogen Bond Donor Count | 0 |
Hydrogen Bond Acceptor Count | 0 |
Rotatable Bond Count | 0 |
Exact Mass | 136.125 |
Monoisotopic Mass | 136.125 |
Topological Polar Surface Area | 0 |
Heavy Atom Count | 10 |
Formal Charge | 0 |
Complexity | 186 |
Isotope Atom Count | 0 |
Defined Atom Stereocenter Count | 2 |
Undefined Atom Stereocenter Count | 0 |
Defined Bond Stereocenter Count | 0 |
Undefined Bond Stereocenter Count | 0 |
Covalently-Bonded Unit Count | 1 |
Insect | Gene Symbol | Validation | Reference |
---|---|---|---|
Dendroctonus ponderosae | CYP345E2 | E | |
Dendroctonus ponderosae | CYP6DE1 | X | |
Dendroctonus armandi | CYP6CR2 | R | |
Dendroctonus armandi | CYP6DE5 | R |