ID: 32047
SMILES:C(C)CCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 32048
SMILES:CC(C)=CCCC(C)=CCc1c(O)c(C2C=C(C)CCC2C(C)C)c(O)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -17.347
InChIKey:YVODSFDYVJCQJH-UHFFFAOYSA-N
ID: 32049
SMILES:CC(C)C1CC=C(C)CC1c1c(O)cc(CCC)cc1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -17.712
InChIKey:SBLQFIJJHXJVBQ-UHFFFAOYSA-N
ID: 32050
SMILES:COCc1c2c(cc(CCCCC)c1)OC(CO)(C)CC2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 292.419
CB1 binding score: -13.216
InChIKey:KEGZCJAOLHRBSB-UHFFFAOYSA-N
ID: 32051
SMILES:C12c3c(O)cc(CCCCC)cc3OC(C)(C)C3C4C(C31)C(C)(O)CCC4O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -16.324
InChIKey:LBRPEJWSXBCSOT-UHFFFAOYSA-N
ID: 32052
SMILES:C(C=Cc1c(O)c2c(cc1O)OC(C)(C)C1CCC(C)=CC12)=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.463
CB1 binding score: -15.888
InChIKey:XVSZOOBREDRDKW-UHFFFAOYSA-N
ID: 32053
SMILES:c1(O)cc(CCCCC)cc(O)c1C1C(C(C)=C)C(C)(C=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.123
InChIKey:WPLABPBNOYJVRD-UHFFFAOYSA-N
ID: 32054
SMILES:c1(CCCCC)cc(O)c2c(c1)OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 32055
SMILES:c1c(S(=O)CC(C)C)c2c(cc1C)OC(C)(C)c1c-2cc(C)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.504
CB1 binding score: -13.589
InChIKey:RGXNDZPWMCFUNA-UHFFFAOYSA-N
ID: 32056
SMILES:c1(O)c2c(c(C(C(CC)C)=O)c(O)c1C)OC(C)(C)C1C2C(O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -15.761
InChIKey:IMVDLSCVGFRLMV-UHFFFAOYSA-N
ID: 32057
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C(C(C)(CCC=C(C)C)C2)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -16.648
InChIKey:LULABODDSLMALF-UHFFFAOYSA-N
ID: 32058
SMILES:CCCCCCc1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 32059
SMILES:OC1(C)CCC(C(=C)C)C(c2c(O)cc(CCC)cc2O)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 306.402
CB1 binding score: -16.716
InChIKey:FNAIYGCHNIBMAR-UHFFFAOYSA-N
ID: 32060
SMILES:C(CCCc1cc2c(c(O)c1)C1C=C(C)CCC1C(C)(C)O2)CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -16.706
InChIKey:XGETXXSZFHQEBA-UHFFFAOYSA-N
ID: 32061
SMILES:C1C(C(C)C)C(C)(CC=C(C)C)c2c(O)cc(CCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -16.233
InChIKey:DLEIFXYCVFPXQA-UHFFFAOYSA-N
ID: 32062
SMILES:C(CCC)Cc1cc2c(c(OC)c1)C=CC(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -18.771
InChIKey:NUDQDNWIMDAJAE-UHFFFAOYSA-N
ID: 32063
SMILES:c1(O)c(CC=C(CCC=C(C)C)C)c(O)cc(CCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -19.824
InChIKey:YJYIDZLGVYOPGU-UHFFFAOYSA-N
ID: 32064
SMILES:C1C2C(C)(CCCC(C)(O)C)Oc3c(c(O)cc(CCCCCC)c3)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -15.341
InChIKey:PDBNRPBVNRBGAY-UHFFFAOYSA-N
ID: 32065
SMILES:CC(C)(O)c1cc2c3c(c1)OC1(C)CC3C(C(C)(C)O2)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Bisabolane sesquiterpenoids;Cannabinoids
MW: 302.414
CB1 binding score: -15.304
InChIKey:OFTHIPYRSFTPBN-UHFFFAOYSA-N
ID: 32066
SMILES:C12C(C)(C)Oc3c(c(OC)cc(CCCCC)c3)C1C=C(CO)C(OC(C(CC)C)=O)C(OC(C(C)=C)=O)C2=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 554.724
CB1 binding score: -14.859
InChIKey:BPSLCUMWYNSUGO-UHFFFAOYSA-N
ID: 32067
SMILES:C(CCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(CO)=CC21)C=Cc1ccc(O)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 450.575
CB1 binding score: -14.553
InChIKey:IYSKQIMMGACSEH-UHFFFAOYSA-N