ID: 121024
SMILES:c1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.47
CB1 binding score: -18.189
InChIKey:AIOSXAOKGBOYPS-UHFFFAOYSA-N
ID: 121025
SMILES:C(c1ccc2c(c1)OC1(C)CCC1C(C)(C)O2)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -14.658
InChIKey:ZYIXUBIHWFPJBO-UHFFFAOYSA-N
ID: 121026
SMILES:C(C(C)C)(=O)CCc1cc2c(c(O)c1)C=CC(C)(CCC=C(C)[CH])O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -14.934
InChIKey:NRKLILJXLQBBLH-UHFFFAOYSA-N
ID: 121027
SMILES:C(C)(=CCc1c(O)cc(CCCCC)c(C(=O)O)c1O)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 121028
SMILES:C12C(C=C(C)C)c3ccc(CCCCC)cc3OC1CC(C)=CCCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.589
CB1 binding score: -13.522
InChIKey:KCSIUSNIWOINIO-UHFFFAOYSA-N
ID: 121029
SMILES:CCOC1C(=C)CCC2C(C(C)=C)C(c3c(OC)cc(CCCCC)cc3O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -14.605
InChIKey:SKXNQLJCPHVXOA-UHFFFAOYSA-N
ID: 121030
SMILES:c1c(CC2C(C(C)(C)O)CC=C(C)C2)c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -11.859
InChIKey:ZVEPKXWMQISAHB-UHFFFAOYSA-N
ID: 121031
SMILES:O1C(=O)C2=C(CCC1=O)c1c(O)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.407
CB1 binding score: -13.743
InChIKey:AGYYOTYFLPTTNF-UHFFFAOYSA-N
ID: 121032
SMILES:C(=C(C)C)CCC1=CC(OC)(c2c(O)cc(O)cc2C(CC(=O)O)CC(CC)[CH])CO1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.541
CB1 binding score: -16.78
InChIKey:HPKVELVJFOKJBN-UHFFFAOYSA-N
ID: 121033
SMILES:c12c(ccc(C)c1)C(C)(C)Oc1cc(CCCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.464
CB1 binding score: -18.696
InChIKey:WUEBHOMMWUKSEU-UHFFFAOYSA-N
ID: 121034
SMILES:c12c(OC)c(C(=O)O)ccc1C(C)(C)Oc1cc(CCCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.472
CB1 binding score: -15.92
InChIKey:UFFOCTGLBLTLSP-UHFFFAOYSA-N
ID: 121035
SMILES:C1C2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C2(C(O)C=C(C)C2)C1(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -13.965
InChIKey:RCKPFGAPYHTHBI-UHFFFAOYSA-N
ID: 121036
SMILES:C(C(=CCCC1(C)C=Cc2c(O)cc(CCCCC)cc2O1)C)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -16.264
InChIKey:DULZRSFTUGQZBT-UHFFFAOYSA-N
ID: 121037
SMILES:c1(CC)cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -15.784
InChIKey:YKKCSUKVPVSXMI-UHFFFAOYSA-N
ID: 121038
SMILES:O1CCC1=CC1Oc2cc(CCCCC)cc(O)c2C2CC(C)=CCC2C(CO)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -13.213
InChIKey:UUWBRBHIVWUNGI-UHFFFAOYSA-N
ID: 121039
SMILES:C1CC(C(C)(C)O)C(c2c(O)cc(CCCCC)cc2OC(C)=O)CC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 376.537
CB1 binding score: -15.521
InChIKey:MCTAWBNQJCWLDF-UHFFFAOYSA-N
ID: 121040
SMILES:CC(C)=CC1c2c(c(O)cc(CCCCC)c2)C(=O)C2(CC(C(C)=C)C2C(=O)OC)C2(C)C1C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.646
CB1 binding score: -15.534
InChIKey:XVTDXOGGKJTUML-UHFFFAOYSA-N
ID: 121041
SMILES:C12C(C)(C)Oc3cc(CCC)cc(c31)C1CC(C(C)=C)CCC1(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -14.593
InChIKey:QCPRLDSNJZWFGZ-UHFFFAOYSA-N
ID: 121042
SMILES:c1(C)c(OC(=O)C)cc2c(c1)OC(C)(C)C1C(O)CC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 316.397
CB1 binding score: -14.151
InChIKey:RRKSWSBWHKIWIM-UHFFFAOYSA-N
ID: 121043
SMILES:C(OCC)(=O)c1cc(O)c2c(c1)OC(C)(C)C1C2CC(CO)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.396
CB1 binding score: -13.679
InChIKey:IKIKDXBAXHPCFA-UHFFFAOYSA-N
ID: 121044
SMILES:C1(C)C(C)(C)Oc2cc(CCCCCC)c(C=O)c(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -15.583
InChIKey:RJPPYWXCCOFXPU-UHFFFAOYSA-N