ID: 17998
SMILES:Oc1c(C(C(C)CC)=O)c2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -18.453
InChIKey:NIZQVFOBIVYVBJ-UHFFFAOYSA-N
ID: 17999
SMILES:CCCCCCc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.964
InChIKey:DMJVNNFBMZZLFB-UHFFFAOYSA-N
ID: 18000
SMILES:C(OCc1cc(OC)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1)CC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.319
InChIKey:CEOFFRHGGLYUGA-UHFFFAOYSA-N
ID: 18001
SMILES:C1(C(=C)C)CC(=O)C2(C)C3(O1)C=CC(C)OC3c1c(O)cc(CCCCC)cc1O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.526
CB1 binding score: -16.857
InChIKey:HFLOSEJZXDJRPU-UHFFFAOYSA-N
ID: 18002
SMILES:c12c(cc(CCCCCO)cc1O)OC(C)(C)C1C2CC(C)(O)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.482
CB1 binding score: -16.42
InChIKey:ZHUXVKUPZBIDMW-UHFFFAOYSA-N
ID: 18003
SMILES:c1(C(=O)O)c(O)c2c(cc1CCCCC)C1C(CC2O)C(C)(C)OC(C)(C)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -16.982
InChIKey:ZVTSOBVVCMQGFA-UHFFFAOYSA-N
ID: 18004
SMILES:C1C(C=CC(C)=CCc2c(O)c(C)cc(OC)c2)(CO)CCC=C1C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -14.081
InChIKey:SROHPABASZRDID-UHFFFAOYSA-N
ID: 18005
SMILES:C(CCCC)c1cc(O)c(C2C(C(C)C)CCC(C)=C2)cc1OC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -16.914
InChIKey:PNMCGYPHKISUAK-UHFFFAOYSA-N
ID: 18006
SMILES:C1C(C)CC2c3c(O)cc(CCCCC)cc3OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 18007
SMILES:C12(C(=O)OC)c3c(O)cc(C)cc3OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.397
CB1 binding score: -15.432
InChIKey:NMKLVGMJDKGGAH-UHFFFAOYSA-N
ID: 18008
SMILES:CC1(C)C2CCC(C)=CC2c2c(O)cc(CCCCCO)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.915
InChIKey:LNEDOGQBWSHVNR-UHFFFAOYSA-N
ID: 18009
SMILES:O1c2c(cc(CCCCC)cc2O)C2C1(C)CCC1(O)C(C)=CC(C=C(C)C)C21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -14.064
InChIKey:NXZVQCVAXGWVTP-UHFFFAOYSA-N
ID: 18010
SMILES:O=C1CC2C(c3c(O)cc(CCCCC)cc3O2)OC=C1C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -14.124
InChIKey:DROOJKIUJRCXGH-UHFFFAOYSA-N
ID: 18011
SMILES:C12C(c3c(cc(CCCCC)cc3O)O1)C1C(CCC1(O)C)C(C)C(=O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 374.477
CB1 binding score: -15.526
InChIKey:DBLHXKQTTCYXJZ-UHFFFAOYSA-N
ID: 18012
SMILES:C1(C)CCC2C(C)(C)Oc3c(c(O)cc(C)c3)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.377
CB1 binding score: -18.804
InChIKey:NJEVKSYKELTXNY-UHFFFAOYSA-N
ID: 18013
SMILES:C(c1cc(O)c2c(c1)OC(C)(C)c1c-2cc(C(OC)=O)cc1)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.392
CB1 binding score: -17.813
InChIKey:FSQGTQJVZXKVAR-UHFFFAOYSA-N
ID: 18014
SMILES:Oc1c(C2C=C(CCC=C(C)CCC=C(C)C)C3C2C(C)(C)O3)cccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.545
CB1 binding score: -15.158
InChIKey:BGYLUCQOGKRNGJ-UHFFFAOYSA-N
ID: 18015
SMILES:CCCc1cc(O)c2c(c1O)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -19.481
InChIKey:MYOPDHQCJOGQJQ-UHFFFAOYSA-N
ID: 18016
SMILES:C1(CC=C(C)CCC=C(C)C)(C)C=Cc2c(O)cc(CCC)c(C(O)=O)c2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.516
CB1 binding score: -7.186
InChIKey:IUWMRCXGBJWAJO-UHFFFAOYSA-N
ID: 18017
SMILES:CC(=CCc1c(O)cc(CCCCOC2C(O)C(O)C(O)C(CO)O2)cc1OC)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.625
CB1 binding score: -14.721
InChIKey:WYSNFZRFTVUEHZ-UHFFFAOYSA-N
ID: 18018
SMILES:C(CCCCCCCC(OCc1cc(OC)c2c(c1)OC(C)(C)C1CC=C(C)CC21)CCCCCCCC)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 540.829
CB1 binding score: -15.341
InChIKey:ADWIPVHOUIGMOQ-UHFFFAOYSA-N