ID: 57961
SMILES:C(Cc1c(CCCCC)cc(O)c(CC=C(C)CCC=C(C)C)c1)(O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.358
InChIKey:YAKHGLDSUVGVIM-UHFFFAOYSA-N
ID: 57962
SMILES:OCc1c(O)c2c(cc1CCCCC)OC(C)(CC1OC(=O)C3=C1CCC(C)(C)O3)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 444.568
CB1 binding score: -14.178
InChIKey:XXMSTCNNBYYCMG-UHFFFAOYSA-N
ID: 57963
SMILES:C(C=C(CC#CC(O)(C)C)Cc1cc(O)c(C2C=C(C)CCC2C(C)=C)c(O)c1)CC(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.647
CB1 binding score: -15.374
InChIKey:HUXOPLJIRLZUOZ-UHFFFAOYSA-N
ID: 57964
SMILES:c1(O)cc(C)c(CC=C(C)CCC=C(C)C)c(O)c1C1C=C(C)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.599
CB1 binding score: -16.631
InChIKey:ZZUWFWMKWUJSBE-UHFFFAOYSA-N
ID: 57965
SMILES:O=C(C)Oc1ccc2c(c1)CCC13C(C)(CC=C1C(C)CCCC(C)C)OC1OC(C)(C)C(=O)C1C32
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 494.672
CB1 binding score: -15.732
InChIKey:AKXTYFCVTMEJSN-UHFFFAOYSA-N
ID: 57966
SMILES:C(C)CCCc1cc(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: 57967
SMILES:C12c3c(O)cc(CCCCC)cc3OC(C)(C)C1CC(C(=C)C)CCC(C)(O)C2O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -16.116
InChIKey:DRJMBDIYFAMAFQ-UHFFFAOYSA-N
ID: 57968
SMILES:C1(C(=C)C)CC(O)C(C)=CC1c1c(O)cc(CCCCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.385
InChIKey:YYLPAYRRVSQJRR-UHFFFAOYSA-N
ID: 57969
SMILES:c1oc(CC2C(C)=CC(c3c(O)cc(CCCCC)cc3)C(C(=C)C)CC2(C)C)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 436.636
CB1 binding score: -14.958
InChIKey:SBHDDQRZHRWCNY-UHFFFAOYSA-N
ID: 57970
SMILES:C(C)CCCc1cc(O)c(CC=C(C)C)c(O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -20.5
InChIKey:YVUPWYODRDEDFU-UHFFFAOYSA-N
ID: 57971
SMILES:O=C1CC2C(C)(Oc3c(c(O)cc(CCCCC)c3)C2C=C(C)C)CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -16.24
InChIKey:BUAKTRFNFFCCJN-UHFFFAOYSA-N
ID: 57972
SMILES:O(C1C(O)C(O)C(O)C(CO)O1)c1ccc2c(c1)OC(C)(C)C1CCC(C)=CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 406.475
CB1 binding score: -15.811
InChIKey:YIAPJOWINIGBHO-UHFFFAOYSA-N
ID: 57973
SMILES:C1CC2(C)Oc3c(c(O)cc(CCCCC)c31)C(OC(=O)C(CC)C)C2C(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 470.694
CB1 binding score: -15.047
InChIKey:JICAVNWUIJRYTG-UHFFFAOYSA-N
ID: 57974
SMILES:C1(C)=CC(c2c(OC(=O)C)cc(CCCCC)cc2)C(C(=C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 340.507
CB1 binding score: -16.438
InChIKey:ATJKXFOHYSSRNX-UHFFFAOYSA-N
ID: 57975
SMILES:C1(C)(C)Oc2c(c(O)cc(CCCCC)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 57976
SMILES:C(CC)CCc1cc2c(c3c1OC(C)(C)C1C4C(C(O)C=CC4O)(C3)C(C)(C)O1)OC(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.623
CB1 binding score: -14.871
InChIKey:GDYHRCXMPDUDTC-UHFFFAOYSA-N
ID: 57977
SMILES:CC(c1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)CC1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -17.909
InChIKey:LUYHZUJNWMSVCU-UHFFFAOYSA-N
ID: 57978
SMILES:C(=C(C)C)CCC(=CCc1c(O)c(C(=O)O)c(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -19.234
InChIKey:SEEZIOZEUUMJME-UHFFFAOYSA-N
ID: 57979
SMILES:O1c2c(c(OC(=O)C)cc(CCCCC)c2)C2C(C)C1C2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -13.295
InChIKey:LIZXVVGJCRYKQM-UHFFFAOYSA-N
ID: 57980
SMILES:c1(CCCCC)cc(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: 57981
SMILES:C1=C(C)CC2C(C(C)(C)Oc3c2c(O)c(CC=C(CCC=C(C)C)C)c(O)c3)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 396.571
CB1 binding score: -16.254
InChIKey:XGGDUIGJWBZGBD-UHFFFAOYSA-N