ID: 65584
SMILES:C1c2c(O)cc(CCCCC)cc2OC(C)(C)C1CCC(O)(C)C#C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -14.278
InChIKey:QBGWPZHPWGNXPF-UHFFFAOYSA-N
ID: 65585
SMILES:c12c(cc(CCCCC)c(C(O)=O)c1O)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 65586
SMILES:O1c2cc(CCCCC)cc(O)c2C2C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.35
InChIKey:BQCPTFCTZRZWCR-UHFFFAOYSA-N
ID: 65587
SMILES:C(CC(C)=CCc1c(O)cc(CCCCC)c(C(=O)O)c1)C=C(C)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.614
CB1 binding score: -16.655
InChIKey:LULRPZYGKXLBAS-UHFFFAOYSA-N
ID: 65588
SMILES:c1(CCc2cc(O)c(CC=C(CO)CCC=C(CCC=C(C)C)C)c(O)c2)ccccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.62
CB1 binding score: -13.842
InChIKey:YJWOWKIARZGURZ-UHFFFAOYSA-N
ID: 65589
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1=CCC(C(=O)O)C12)C(C)(O)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.423
CB1 binding score: -15.984
InChIKey:SYKJUNAOEKCUSJ-UHFFFAOYSA-N
ID: 65590
SMILES:OCC1(O)C2CC3(C(CC2)c2c(O)cc(CCCCC)cc2OC3)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.737
InChIKey:QKJCGBGHYFRKBY-UHFFFAOYSA-N
ID: 65591
SMILES:C(C)CCCCCCCCCCCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(CC(OC)=O)(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 500.764
CB1 binding score: -14.709
InChIKey:FFGJFGDVTONVEY-UHFFFAOYSA-N
ID: 65592
SMILES:c1(O)c(C(C(=C)CC)C)c2c3c(c1O)OC(C)(C)C1CC(=C(C)CC2)C(=O)C1(C(=O)C(CC)C)C3C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 534.737
CB1 binding score: -12.223
InChIKey:FYLOZFBAMZZTBE-UHFFFAOYSA-N
ID: 65593
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 65594
SMILES:C(CCCCc1cc2c(c(O)c1)C1C(C(C=O)=CCC1C(=C)C)O2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -13.623
InChIKey:QSACCLHPJJCOAQ-UHFFFAOYSA-N
ID: 65595
SMILES:CC1(COP(O)(O)=O)C2CCC(C)=CC2c2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.447
CB1 binding score: -14.972
InChIKey:SMFVMYGASGROHS-UHFFFAOYSA-N
ID: 65596
SMILES:C(Cc1cc(O)c(CC=C(C(CC=C(C)C)O)C)cc1O)=C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -15.903
InChIKey:RPKCJCYBADGHKP-UHFFFAOYSA-N
ID: 65597
SMILES:C(C(CC(=CCCCC1CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1)OC(C)=O)(O)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 514.747
CB1 binding score: -15.323
InChIKey:QNZYHDLITJFTSU-UHFFFAOYSA-N
ID: 65598
SMILES:CC(=CC1OC(OC)C(C)OC1c1c(O)c2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.568
CB1 binding score: -16.156
InChIKey:HNJDTZGBSHODJO-UHFFFAOYSA-N
ID: 65599
SMILES:C(=O)(O)c1c(N=C(O)C(C)C)cc2c(c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 357.45
CB1 binding score: -14.879
InChIKey:UEPVOMDEQAENHC-UHFFFAOYSA-N
ID: 65600
SMILES:C1(C(C)C)CCC(C)C2C1c1c(cc(C(C)(O)CCCCC)cc1O)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -15.618
InChIKey:SMOOVTIMXWQTSN-UHFFFAOYSA-N
ID: 65601
SMILES:c12c(OC)cc(CCCCC)cc1OC(C)(C)c1ccc(C)cc1-2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.464
CB1 binding score: -18.629
InChIKey:YEDIZIGYIMTZKP-UHFFFAOYSA-N
ID: 65602
SMILES:C1(C)c2c(c(O)cc(CCCCC)c2)OC(C)(C)C1CCC=C(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.658
CB1 binding score: -16.335
InChIKey:BZBYZUNZOGOBEQ-UHFFFAOYSA-N
ID: 65603
SMILES:C(CCC)Cc1cc(O)c(C2C=C(C)CCC2C(=C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.427
InChIKey:QHMBSVQNZZTUGM-UHFFFAOYSA-N
ID: 65604
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N